3-(methylamino)-1H-quinolin-4-one

C10H10N2O — CID 119084506

IUPAC3-(methylamino)-1H-quinolin-4-one
SMILESCNc1c[nH]c2ccccc2c1=O
InChIInChI=1S/C10H10N2O/c1-11-9-6-12-8-5-3-2-4-7(8)10(9)13/h2-6,11H,1H3,(H,12,13)
InChIKeyPJNXLHHPAOGKCQ-UHFFFAOYSA-N
MW174.20 g/mol
LogP1.57
Rot. Bonds1

About 3-(methylamino)-1H-quinolin-4-one

3-(methylamino)-1H-quinolin-4-one (PubChem CID 119084506) has the molecular formula C10H10N2O and a molecular weight of 174.20 g/mol. Its IUPAC name is 3-(methylamino)-1H-quinolin-4-one.

Molecular Properties

Compound Name3-(methylamino)-1H-quinolin-4-one
PubChem CID119084506
Molecular FormulaC10H10N2O
Molecular Weight174.20 g/mol
Exact Mass174.08
IUPAC Name3-(methylamino)-1H-quinolin-4-one
SMILESCNc1c[nH]c2ccccc2c1=O
InChIInChI=1S/C10H10N2O/c1-11-9-6-12-8-5-3-2-4-7(8)10(9)13/h2-6,11H,1H3,(H,12,13)
InChIKeyPJNXLHHPAOGKCQ-UHFFFAOYSA-N
XLogP1.57
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.20
LogP ≤ 51.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-1H-indol-3-amine;oxalic acid
CID 69068496
3-ethyl-1H-quinolin-4-one
CID 10374897
3-methyl-1H-indole;N-methylmethanamine
CID 68994741
N-ethyl-1H-indol-3-amine
CID 22497863
N'-(1H-indol-3-yl)methanediamine
CID 115225408
3-(4-methylphenyl)-1H-quinolin-4-one
CID 15930283
N'-(1H-indol-3-yl)-N-methylethane-1,2-diamine
CID 115195726
1H-indol-3-ylcarbamic acid
CID 66672709
4-(methylamino)-1H-quinolin-2-one
CID 23884668
ethane;N-(2-methylphenyl)-4-oxo-1H-quinoline-3-carboxamide;propane
CID 90785095
N-(1H-indol-3-yl)-2-methyl-2-(methylamino)propanamide
CID 115165574
N'-(1H-indol-3-yl)-N-methylbutane-1,4-diamine
CID 115201685

Frequently Asked Questions

What is the IUPAC name of 3-(methylamino)-1H-quinolin-4-one?
The IUPAC name of 3-(methylamino)-1H-quinolin-4-one (CID 119084506) is 3-(methylamino)-1H-quinolin-4-one.
What is the SMILES notation for 3-(methylamino)-1H-quinolin-4-one?
The canonical SMILES for 3-(methylamino)-1H-quinolin-4-one is CNc1c[nH]c2ccccc2c1=O.
What is the InChIKey of 3-(methylamino)-1H-quinolin-4-one?
The InChIKey is PJNXLHHPAOGKCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O/c1-11-9-6-12-8-5-3-2-4-7(8)10(9)13/h2-6,11H,1H3,(H,12,13).
What are the key properties of 3-(methylamino)-1H-quinolin-4-one?
3-(methylamino)-1H-quinolin-4-one has a molecular weight of 174.20 g/mol, XLogP of 1.57, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methylamino)-1H-quinolin-4-one is sourced from PubChem (CID 119084506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).