2-methyl-3-quinolin-3-ylpropan-1-amine

C13H16N2 — CID 64664749

IUPAC2-methyl-3-quinolin-3-ylpropan-1-amine
SMILESCC(CN)Cc1cnc2ccccc2c1
InChIInChI=1S/C13H16N2/c1-10(8-14)6-11-7-12-4-2-3-5-13(12)15-9-11/h2-5,7,9-10H,6,8,14H2,1H3
InChIKeyVIUIKJJRFANNIQ-UHFFFAOYSA-N
MW200.29 g/mol
LogP2.37
Rot. Bonds3

About 2-methyl-3-quinolin-3-ylpropan-1-amine

2-methyl-3-quinolin-3-ylpropan-1-amine (PubChem CID 64664749) has the molecular formula C13H16N2 and a molecular weight of 200.29 g/mol. Its IUPAC name is 2-methyl-3-quinolin-3-ylpropan-1-amine.

Molecular Properties

Compound Name2-methyl-3-quinolin-3-ylpropan-1-amine
PubChem CID64664749
Molecular FormulaC13H16N2
Molecular Weight200.29 g/mol
Exact Mass200.13
IUPAC Name2-methyl-3-quinolin-3-ylpropan-1-amine
SMILESCC(CN)Cc1cnc2ccccc2c1
InChIInChI=1S/C13H16N2/c1-10(8-14)6-11-7-12-4-2-3-5-13(12)15-9-11/h2-5,7,9-10H,6,8,14H2,1H3
InChIKeyVIUIKJJRFANNIQ-UHFFFAOYSA-N
XLogP2.37
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.29
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-methyl-3-quinolin-3-ylpropan-1-amine with MolForge

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

Launch Full Analysis

Related Compounds

3-(2-methylpropyl)quinoline
CID 12072851
2-quinolin-3-ylethanamine;hydrochloride
CID 68724239
1-(quinolin-3-ylmethylamino)ethanol
CID 143559456
3-(3-chloro-4-methylpentyl)quinoline
CID 64508881
2-methyl-3-phenylpropan-1-amine
CID 12672558
2-methyl-N-(2-quinolin-3-ylethyl)propan-1-amine
CID 62603664
2-quinolin-3-ylethanol
CID 53403774
ethane;2-methyl-3-phenylpropan-1-amine
CID 90796605
N-(quinolin-3-ylmethyl)ethanamine
CID 16640553
3-ethylquinoline;quinoline
CID 174966721
3-(3,3-dimethylbutyl)quinoline
CID 58808300
molecular hydrogen;N-(quinolin-3-ylmethyl)butan-2-amine
CID 142196706

Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-quinolin-3-ylpropan-1-amine?
The IUPAC name of 2-methyl-3-quinolin-3-ylpropan-1-amine (CID 64664749) is 2-methyl-3-quinolin-3-ylpropan-1-amine.
What is the SMILES notation for 2-methyl-3-quinolin-3-ylpropan-1-amine?
The canonical SMILES for 2-methyl-3-quinolin-3-ylpropan-1-amine is CC(CN)Cc1cnc2ccccc2c1.
What is the InChIKey of 2-methyl-3-quinolin-3-ylpropan-1-amine?
The InChIKey is VIUIKJJRFANNIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2/c1-10(8-14)6-11-7-12-4-2-3-5-13(12)15-9-11/h2-5,7,9-10H,6,8,14H2,1H3.
What are the key properties of 2-methyl-3-quinolin-3-ylpropan-1-amine?
2-methyl-3-quinolin-3-ylpropan-1-amine has a molecular weight of 200.29 g/mol, XLogP of 2.37, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-quinolin-3-ylpropan-1-amine is sourced from PubChem (CID 64664749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).