7-methyl-3-[[methyl(pyridin-2-ylmethyl)amino]methyl]-1H-quinolin-2-one

C18H19N3O — CID 56721286

IUPAC7-methyl-3-[[methyl(pyridin-2-ylmethyl)amino]methyl]-1H-quinolin-2-one
SMILESCc1ccc2cc(CN(C)Cc3ccccn3)c(=O)[nH]c2c1
InChIInChI=1S/C18H19N3O/c1-13-6-7-14-10-15(18(22)20-17(14)9-13)11-21(2)12-16-5-3-4-8-19-16/h3-10H,11-12H2,1-2H3,(H,20,22)
InChIKeyHMRBKERAGAEQIV-UHFFFAOYSA-N
MW293.37 g/mol
LogP2.86
Rot. Bonds4

About 7-methyl-3-[[methyl(pyridin-2-ylmethyl)amino]methyl]-1H-quinolin-2-one

7-methyl-3-[[methyl(pyridin-2-ylmethyl)amino]methyl]-1H-quinolin-2-one (PubChem CID 56721286) has the molecular formula C18H19N3O and a molecular weight of 293.37 g/mol. Its IUPAC name is 7-methyl-3-[[methyl(pyridin-2-ylmethyl)amino]methyl]-1H-quinolin-2-one.

Molecular Properties

Compound Name7-methyl-3-[[methyl(pyridin-2-ylmethyl)amino]methyl]-1H-quinolin-2-one
PubChem CID56721286
Molecular FormulaC18H19N3O
Molecular Weight293.37 g/mol
Exact Mass293.15
IUPAC Name7-methyl-3-[[methyl(pyridin-2-ylmethyl)amino]methyl]-1H-quinolin-2-one
SMILESCc1ccc2cc(CN(C)Cc3ccccn3)c(=O)[nH]c2c1
InChIInChI=1S/C18H19N3O/c1-13-6-7-14-10-15(18(22)20-17(14)9-13)11-21(2)12-16-5-3-4-8-19-16/h3-10H,11-12H2,1-2H3,(H,20,22)
InChIKeyHMRBKERAGAEQIV-UHFFFAOYSA-N
XLogP2.86
TPSA48.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

7-fluoro-3-[[methyl(2-pyridin-2-ylethyl)amino]methyl]-1H-quinolin-2-one
CID 56723183
6-methyl-3-[[methyl-[(3-pyridin-2-yl-1,2-oxazol-5-yl)methyl]amino]methyl]-1H-quinolin-2-one
CID 56714804
N-methyl-N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]acetamide
CID 930563
3-[2-(dimethylamino)ethyl]-1-[(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(pyridin-2-ylmethyl)thiourea
CID 169196854
N-[2-(7-methyl-2-oxo-1H-quinolin-3-yl)ethyl]pyridine-2-carboxamide
CID 110662758
N-methyl-1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine;hydrochloride
CID 174963433
ethane;N-methyl-1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine
CID 145471467
3-[[[(R)-cyclopropyl(pyridin-2-yl)methyl]-methylamino]methyl]-6-methyl-1H-quinolin-2-one
CID 95216100
N-methyl-3-(6-methyl-2-oxo-1H-quinolin-3-yl)-N-(2-pyridin-2-ylethyl)propanamide
CID 53174667
3-[[methyl-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]amino]methyl]-1H-quinolin-2-one
CID 56711403
2-(dimethylamino)-N-[2-(7-methyl-2-oxo-1H-quinolin-3-yl)ethyl]pyridine-3-carboxamide
CID 110616799
3-[[methyl-[(3-methyl-1H-indol-2-yl)methyl]amino]methyl]-1H-quinolin-2-one
CID 56703217

Frequently Asked Questions

What is the IUPAC name of 7-methyl-3-[[methyl(pyridin-2-ylmethyl)amino]methyl]-1H-quinolin-2-one?
The IUPAC name of 7-methyl-3-[[methyl(pyridin-2-ylmethyl)amino]methyl]-1H-quinolin-2-one (CID 56721286) is 7-methyl-3-[[methyl(pyridin-2-ylmethyl)amino]methyl]-1H-quinolin-2-one.
What is the SMILES notation for 7-methyl-3-[[methyl(pyridin-2-ylmethyl)amino]methyl]-1H-quinolin-2-one?
The canonical SMILES for 7-methyl-3-[[methyl(pyridin-2-ylmethyl)amino]methyl]-1H-quinolin-2-one is Cc1ccc2cc(CN(C)Cc3ccccn3)c(=O)[nH]c2c1.
What is the InChIKey of 7-methyl-3-[[methyl(pyridin-2-ylmethyl)amino]methyl]-1H-quinolin-2-one?
The InChIKey is HMRBKERAGAEQIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O/c1-13-6-7-14-10-15(18(22)20-17(14)9-13)11-21(2)12-16-5-3-4-8-19-16/h3-10H,11-12H2,1-2H3,(H,20,22).
What are the key properties of 7-methyl-3-[[methyl(pyridin-2-ylmethyl)amino]methyl]-1H-quinolin-2-one?
7-methyl-3-[[methyl(pyridin-2-ylmethyl)amino]methyl]-1H-quinolin-2-one has a molecular weight of 293.37 g/mol, XLogP of 2.86, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-3-[[methyl(pyridin-2-ylmethyl)amino]methyl]-1H-quinolin-2-one is sourced from PubChem (CID 56721286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).