2-(Benzyloxy)-5-bromopyridin-3-amine

• CAS: 1245648-37-6
• Catalog Number: ACM1245648376
• Category: Bromine Series
• Molecular Weight: 279.132540 [g/mol]
• Molecular Formula: C12H11BrN2O
• Synonyms: 2-(benzyloxy)-5-bromopyridin-3-amine, 1245648-37-6, PubChem20356, AGN-PC-0DACVB, AKOS010476983, 5-bromo-2-phenylmethoxypyridin-3-amine, AK129429, KB-15397
• IUPAC Name: 5-bromo-2-phenylmethoxypyridin-3-amine
• Canonical SMILES: C1=CC=C(C=C1)COC2=NC=C(C=C2N)Br
• InChI Key: JFPLHVNJHOJVPF-UHFFFAOYSA-N
• Exact Mass: 278.00500
• H-Bond Acceptor: 3
• H-Bond Donor: 1

Custom Q&A

What is the molecular formula of the compound 2-(Benzyloxy)-5-bromopyridin-3-amine?

The molecular formula is C12H11BrN2O.

When was this compound created and modified?

It was created on 2012-08-27 and modified on 2023-12-02.

What is the computed IUPAC name of this compound?

The computed IUPAC name is 5-bromo-2-phenylmethoxypyridin-3-amine.

What is the molecular weight of the compound?

The molecular weight is 279.13 g/mol.

What is the InChIKey of the compound?

The InChIKey is JFPLHVNJHOJVPF-UHFFFAOYSA-N.

How many hydrogen bond donor counts are there in the compound?

There is 1 hydrogen bond donor count.

What is the XLogP3-AA value of the compound?

The XLogP3-AA value is 2.7.

What is the topological polar surface area of the compound?

The topological polar surface area is 48.1Ų.

How many rotatable bond counts are in the compound?

There are 3 rotatable bond counts.

Is the compound canonicalized?

Yes, the compound is canonicalized.