3-ethyl-6-methyl-5-(quinolin-3-ylamino)-1H-pyridin-2-one

C17H17N3O — CID 11623288

IUPAC3-ethyl-6-methyl-5-(quinolin-3-ylamino)-1H-pyridin-2-one
SMILESCCc1cc(Nc2cnc3ccccc3c2)c(C)[nH]c1=O
InChIInChI=1S/C17H17N3O/c1-3-12-9-16(11(2)19-17(12)21)20-14-8-13-6-4-5-7-15(13)18-10-14/h4-10,20H,3H2,1-2H3,(H,19,21)
InChIKeyZQMZXWBXHZPRQA-UHFFFAOYSA-N
MW279.34 g/mol
LogP3.54
Rot. Bonds3

About 3-ethyl-6-methyl-5-(quinolin-3-ylamino)-1H-pyridin-2-one

3-ethyl-6-methyl-5-(quinolin-3-ylamino)-1H-pyridin-2-one (PubChem CID 11623288) has the molecular formula C17H17N3O and a molecular weight of 279.34 g/mol. Its IUPAC name is 3-ethyl-6-methyl-5-(quinolin-3-ylamino)-1H-pyridin-2-one.

Molecular Properties

Compound Name3-ethyl-6-methyl-5-(quinolin-3-ylamino)-1H-pyridin-2-one
PubChem CID11623288
Molecular FormulaC17H17N3O
Molecular Weight279.34 g/mol
Exact Mass279.14
IUPAC Name3-ethyl-6-methyl-5-(quinolin-3-ylamino)-1H-pyridin-2-one
SMILESCCc1cc(Nc2cnc3ccccc3c2)c(C)[nH]c1=O
InChIInChI=1S/C17H17N3O/c1-3-12-9-16(11(2)19-17(12)21)20-14-8-13-6-4-5-7-15(13)18-10-14/h4-10,20H,3H2,1-2H3,(H,19,21)
InChIKeyZQMZXWBXHZPRQA-UHFFFAOYSA-N
XLogP3.54
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.34
LogP ≤ 53.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-ethyl-1H-benzo[b][1,8]naphthyridin-2-one
CID 59093558
5,6-dimethyl-3-quinolin-3-yl-1H-pyrazin-2-one
CID 106513767
5-iodo-4-(quinolin-3-ylamino)-1H-pyrimidin-6-one
CID 136971241
4-bromo-2-ethyl-N-quinolin-3-ylbenzenesulfonamide
CID 3814344
N-[(4-ethylphenyl)methyl]quinolin-3-amine
CID 43691167
N-(3-bromo-4-pyridinyl)quinolin-3-amine
CID 113452158
N-(2-methyl-1,3-dihydroisoindol-5-yl)quinolin-3-amine
CID 82536084
N-bis(quinolin-3-ylamino)phosphorylquinolin-3-amine
CID 139034507
3-ethyl-6-methyl-1H-1,8-naphthyridin-2-one
CID 118005009
5-fluoro-2-(quinolin-3-ylamino)benzoic acid
CID 82535805
N-quinolin-3-ylhydroxylamine
CID 54286324
4,4-diethyl-N-quinolin-3-yl-5H-1,3-thiazol-2-amine
CID 62781973

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-6-methyl-5-(quinolin-3-ylamino)-1H-pyridin-2-one?
The IUPAC name of 3-ethyl-6-methyl-5-(quinolin-3-ylamino)-1H-pyridin-2-one (CID 11623288) is 3-ethyl-6-methyl-5-(quinolin-3-ylamino)-1H-pyridin-2-one.
What is the SMILES notation for 3-ethyl-6-methyl-5-(quinolin-3-ylamino)-1H-pyridin-2-one?
The canonical SMILES for 3-ethyl-6-methyl-5-(quinolin-3-ylamino)-1H-pyridin-2-one is CCc1cc(Nc2cnc3ccccc3c2)c(C)[nH]c1=O.
What is the InChIKey of 3-ethyl-6-methyl-5-(quinolin-3-ylamino)-1H-pyridin-2-one?
The InChIKey is ZQMZXWBXHZPRQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3O/c1-3-12-9-16(11(2)19-17(12)21)20-14-8-13-6-4-5-7-15(13)18-10-14/h4-10,20H,3H2,1-2H3,(H,19,21).
What are the key properties of 3-ethyl-6-methyl-5-(quinolin-3-ylamino)-1H-pyridin-2-one?
3-ethyl-6-methyl-5-(quinolin-3-ylamino)-1H-pyridin-2-one has a molecular weight of 279.34 g/mol, XLogP of 3.54, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-6-methyl-5-(quinolin-3-ylamino)-1H-pyridin-2-one is sourced from PubChem (CID 11623288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).