What is the molecular formula of 1-isopropyl-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline?
The molecular formula is C14H21NO2.
What is the molecular weight of 1-isopropyl-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline?
The molecular weight is 235.32 g/mol.
What is the IUPAC name of 1-isopropyl-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline?
The IUPAC name is 6,7-dimethoxy-1-propan-2-yl-1,2,3,4-tetrahydroisoquinoline.
What is the InChI of 1-isopropyl-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline?
The InChI is InChI=1S/C14H21NO2/c1-9(2)14-11-8-13(17-4)12(16-3)7-10(11)5-6-15-14/h7-9,14-15H,5-6H2,1-4H3.
What is the InChIKey of 1-isopropyl-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline?
The InChIKey is IRWSLTSAQIJKQL-UHFFFAOYSA-N.
What is the Canonical SMILES of 1-isopropyl-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline?
The Canonical SMILES is CC(C)C1C2=CC(=C(C=C2CCN1)OC)OC.
What is the XLogP3-AA value of 1-isopropyl-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline?
The XLogP3-AA value is 2.6.
How many hydrogen bond donor count does 1-isopropyl-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline have?
It has 1 hydrogen bond donor count.
How many hydrogen bond acceptor count does 1-isopropyl-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline have?
It has 3 hydrogen bond acceptor count.
How many rotatable bond count does 1-isopropyl-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline have?
It has 3 rotatable bond count.