3-methyl-N-(3-methylcyclohexyl)quinolin-2-amine

C17H22N2 — CID 63535243

IUPAC3-methyl-N-(3-methylcyclohexyl)quinolin-2-amine
SMILESCc1cc2ccccc2nc1NC1CCCC(C)C1
InChIInChI=1S/C17H22N2/c1-12-6-5-8-15(10-12)18-17-13(2)11-14-7-3-4-9-16(14)19-17/h3-4,7,9,11-12,15H,5-6,8,10H2,1-2H3,(H,18,19)
InChIKeyBPEPQXUZCAOKFJ-UHFFFAOYSA-N
MW254.38 g/mol
LogP4.53
Rot. Bonds2

About 3-methyl-N-(3-methylcyclohexyl)quinolin-2-amine

3-methyl-N-(3-methylcyclohexyl)quinolin-2-amine (PubChem CID 63535243) has the molecular formula C17H22N2 and a molecular weight of 254.38 g/mol. Its IUPAC name is 3-methyl-N-(3-methylcyclohexyl)quinolin-2-amine.

Molecular Properties

Compound Name3-methyl-N-(3-methylcyclohexyl)quinolin-2-amine
PubChem CID63535243
Molecular FormulaC17H22N2
Molecular Weight254.38 g/mol
Exact Mass254.18
IUPAC Name3-methyl-N-(3-methylcyclohexyl)quinolin-2-amine
SMILESCc1cc2ccccc2nc1NC1CCCC(C)C1
InChIInChI=1S/C17H22N2/c1-12-6-5-8-15(10-12)18-17-13(2)11-14-7-3-4-9-16(14)19-17/h3-4,7,9,11-12,15H,5-6,8,10H2,1-2H3,(H,18,19)
InChIKeyBPEPQXUZCAOKFJ-UHFFFAOYSA-N
XLogP4.53
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.38
LogP ≤ 54.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-methyl-N-(3-methylcyclohexyl)quinolin-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 3-methyl-N-(3-methylcyclohexyl)quinolin-2-amine?
The IUPAC name of 3-methyl-N-(3-methylcyclohexyl)quinolin-2-amine (CID 63535243) is 3-methyl-N-(3-methylcyclohexyl)quinolin-2-amine.
What is the SMILES notation for 3-methyl-N-(3-methylcyclohexyl)quinolin-2-amine?
The canonical SMILES for 3-methyl-N-(3-methylcyclohexyl)quinolin-2-amine is Cc1cc2ccccc2nc1NC1CCCC(C)C1.
What is the InChIKey of 3-methyl-N-(3-methylcyclohexyl)quinolin-2-amine?
The InChIKey is BPEPQXUZCAOKFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2/c1-12-6-5-8-15(10-12)18-17-13(2)11-14-7-3-4-9-16(14)19-17/h3-4,7,9,11-12,15H,5-6,8,10H2,1-2H3,(H,18,19).
What are the key properties of 3-methyl-N-(3-methylcyclohexyl)quinolin-2-amine?
3-methyl-N-(3-methylcyclohexyl)quinolin-2-amine has a molecular weight of 254.38 g/mol, XLogP of 4.53, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(3-methylcyclohexyl)quinolin-2-amine is sourced from PubChem (CID 63535243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).