N-methyl-1H-isoquinolin-2-amine

C10H12N2 — CID 89267020

IUPACN-methyl-1H-isoquinolin-2-amine
SMILESCNN1C=Cc2ccccc2C1
InChIInChI=1S/C10H12N2/c1-11-12-7-6-9-4-2-3-5-10(9)8-12/h2-7,11H,8H2,1H3
InChIKeyFXSMDDBVGUVRCI-UHFFFAOYSA-N
MW160.22 g/mol
LogP1.61
Rot. Bonds1

About N-methyl-1H-isoquinolin-2-amine

N-methyl-1H-isoquinolin-2-amine (PubChem CID 89267020) has the molecular formula C10H12N2 and a molecular weight of 160.22 g/mol. Its IUPAC name is N-methyl-1H-isoquinolin-2-amine.

Molecular Properties

Compound NameN-methyl-1H-isoquinolin-2-amine
PubChem CID89267020
Molecular FormulaC10H12N2
Molecular Weight160.22 g/mol
Exact Mass160.10
IUPAC NameN-methyl-1H-isoquinolin-2-amine
SMILESCNN1C=Cc2ccccc2C1
InChIInChI=1S/C10H12N2/c1-11-12-7-6-9-4-2-3-5-10(9)8-12/h2-7,11H,8H2,1H3
InChIKeyFXSMDDBVGUVRCI-UHFFFAOYSA-N
XLogP1.61
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.22
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-methyl-1H-isoquinolin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-methyl-1H-isoquinolin-2-amine?
The IUPAC name of N-methyl-1H-isoquinolin-2-amine (CID 89267020) is N-methyl-1H-isoquinolin-2-amine.
What is the SMILES notation for N-methyl-1H-isoquinolin-2-amine?
The canonical SMILES for N-methyl-1H-isoquinolin-2-amine is CNN1C=Cc2ccccc2C1.
What is the InChIKey of N-methyl-1H-isoquinolin-2-amine?
The InChIKey is FXSMDDBVGUVRCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2/c1-11-12-7-6-9-4-2-3-5-10(9)8-12/h2-7,11H,8H2,1H3.
What are the key properties of N-methyl-1H-isoquinolin-2-amine?
N-methyl-1H-isoquinolin-2-amine has a molecular weight of 160.22 g/mol, XLogP of 1.61, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1H-isoquinolin-2-amine is sourced from PubChem (CID 89267020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).