3-(aminomethyl)-6-methyl-1H-quinolin-2-one

C11H12N2O — CID 6487618

IUPAC3-(aminomethyl)-6-methyl-1H-quinolin-2-one
SMILESCc1ccc2[nH]c(=O)c(CN)cc2c1
InChIInChI=1S/C11H12N2O/c1-7-2-3-10-8(4-7)5-9(6-12)11(14)13-10/h2-5H,6,12H2,1H3,(H,13,14)
InChIKeyFMXMFMXSJFZSSB-UHFFFAOYSA-N
MW188.23 g/mol
LogP1.30
Rot. Bonds1

About 3-(aminomethyl)-6-methyl-1H-quinolin-2-one

3-(aminomethyl)-6-methyl-1H-quinolin-2-one (PubChem CID 6487618) has the molecular formula C11H12N2O and a molecular weight of 188.23 g/mol. Its IUPAC name is 3-(aminomethyl)-6-methyl-1H-quinolin-2-one.

Molecular Properties

Compound Name3-(aminomethyl)-6-methyl-1H-quinolin-2-one
PubChem CID6487618
Molecular FormulaC11H12N2O
Molecular Weight188.23 g/mol
Exact Mass188.09
IUPAC Name3-(aminomethyl)-6-methyl-1H-quinolin-2-one
SMILESCc1ccc2[nH]c(=O)c(CN)cc2c1
InChIInChI=1S/C11H12N2O/c1-7-2-3-10-8(4-7)5-9(6-12)11(14)13-10/h2-5H,6,12H2,1H3,(H,13,14)
InChIKeyFMXMFMXSJFZSSB-UHFFFAOYSA-N
XLogP1.30
TPSA58.88 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 51.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

6-amino-3-(aminomethyl)-1H-quinolin-2-one
CID 82504541
6-methyl-3-(propylaminomethyl)-1H-quinolin-2-one
CID 97057433
3-[(2,6-dimethylanilino)methyl]-6-methyl-1H-quinolin-2-one
CID 25318648
6-methyl-3-(piperidin-4-ylmethyl)-1H-quinolin-2-one
CID 84635994
3-(aminomethyl)-6,8-dimethyl-1H-quinolin-2-one
CID 6487599
6-methyl-3-[2-(methylamino)but-3-ynyl]-1H-quinolin-2-one
CID 170631820
N-ethyl-N-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]acetamide
CID 947723
3-[(cyclopentylamino)methyl]-6-methyl-1H-quinolin-2-one
CID 863819
3-[(4-chloroanilino)methyl]-6-methyl-1H-quinolin-2-one
CID 25318659
N-[2-(6-methyl-2-oxo-1H-quinolin-3-yl)ethyl]propanamide
CID 71684039
cyclohexyl-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]azanium
CID 7447307
3-(6-methyl-2-oxo-1H-quinolin-3-yl)-N-(4-methylphenyl)propanamide
CID 110331250

Frequently Asked Questions

What is the IUPAC name of 3-(aminomethyl)-6-methyl-1H-quinolin-2-one?
The IUPAC name of 3-(aminomethyl)-6-methyl-1H-quinolin-2-one (CID 6487618) is 3-(aminomethyl)-6-methyl-1H-quinolin-2-one.
What is the SMILES notation for 3-(aminomethyl)-6-methyl-1H-quinolin-2-one?
The canonical SMILES for 3-(aminomethyl)-6-methyl-1H-quinolin-2-one is Cc1ccc2[nH]c(=O)c(CN)cc2c1.
What is the InChIKey of 3-(aminomethyl)-6-methyl-1H-quinolin-2-one?
The InChIKey is FMXMFMXSJFZSSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O/c1-7-2-3-10-8(4-7)5-9(6-12)11(14)13-10/h2-5H,6,12H2,1H3,(H,13,14).
What are the key properties of 3-(aminomethyl)-6-methyl-1H-quinolin-2-one?
3-(aminomethyl)-6-methyl-1H-quinolin-2-one has a molecular weight of 188.23 g/mol, XLogP of 1.30, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(aminomethyl)-6-methyl-1H-quinolin-2-one is sourced from PubChem (CID 6487618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).