N-Methylcytisine

• CAS: 486-86-2
• Catalog Number: ACM486862
• Category: Amines
• Molecular Weight: 204.27
• Molecular Formula: C₁₂H₁₅NO
• Synonyms: Caulophylline
• InChI: InChI=1S/C12H16N2O/c1-13-6-9-5-10(8-13)11-3-2-4-12(15)14(11)7-9/h2-4,9-10H,5-8H2,1H3/t9-,10+/m0/s1
• InChI Key: CULUKMPMGVXCEI-VHSXEESVSA-N
• Melting Point: 137-139 °C
• Complexity: 359
• Covalently-Bonded Unit Count: 1
• Defined Atom Stereocenter Count: 2
• Exact Mass: 204.126263138
• Hazard Statements: H302
• Heavy Atom Count: 15
• Hydrogen Bond Acceptor Count: 2
• Hydrogen Bond Donor Count: 0
• Isomeric SMILES: CN1C[C@@H]2C[C@H](C1)C3=CC=CC(=O)N3C2
• Monoisotopic Mass: 204.126263138
• Physical State: Powder
• RIDADR: NONH for all modes of transport
• Rotatable Bond Count: 0
• Symbol: GHS07
• Topological Polar Surface Area: 23.6 Ų

Custom Q&A

What is the molecular formula of N-Methylcytisine?

The molecular formula of N-Methylcytisine is C12H16N2O.

What is the molecular weight of N-Methylcytisine?

The molecular weight of N-Methylcytisine is 204.27 g/mol.

What is the IUPAC name of N-Methylcytisine?

The IUPAC name of N-Methylcytisine is (1R,9S)-11-methyl-7,11-diazatricyclo[7.3.1.0 2,7 ]trideca-2,4-dien-6-one.

What is the InChI of N-Methylcytisine?

The InChI of N-Methylcytisine is InChI=1S/C12H16N2O/c1-13-6-9-5-10(8-13)11-3-2-4-12(15)14(11)7-9/h2-4,9-10H,5-8H2,1H3/t9-,10+/m0/s1.

How many hydrogen bond acceptors does N-Methylcytisine have?

N-Methylcytisine has 2 hydrogen bond acceptors.

What is the exact mass of N-Methylcytisine?

The exact mass of N-Methylcytisine is 204.126263138 g/mol.

How many defined atom stereocenters does N-Methylcytisine have?

N-Methylcytisine has 2 defined atom stereocenters.

What is the topological polar surface area of N-Methylcytisine?

The topological polar surface area of N-Methylcytisine is 23.6Ų.

What is the Canonical SMILES of N-Methylcytisine?

The Canonical SMILES of N-Methylcytisine is CN1CC2CC(C1)C3=CC=CC(=O)N3C2.

In which organisms is N-Methylcytisine a natural product found in?

N-Methylcytisine is a natural product found in Thermopsis lanceolata, Sophora chrysophylla, and other organisms with data available.