8-methyl-1-(pyridine-3-carbonyl)-2,3-dihydroquinolin-4-one

C16H14N2O2 — CID 110635490

IUPAC8-methyl-1-(pyridine-3-carbonyl)-2,3-dihydroquinolin-4-one
SMILESCc1cccc2c1N(C(=O)c1cccnc1)CCC2=O
InChIInChI=1S/C16H14N2O2/c1-11-4-2-6-13-14(19)7-9-18(15(11)13)16(20)12-5-3-8-17-10-12/h2-6,8,10H,7,9H2,1H3
InChIKeyZPYXILVGYCSHQQ-UHFFFAOYSA-N
MW266.30 g/mol
LogP2.62
Rot. Bonds1

About 8-methyl-1-(pyridine-3-carbonyl)-2,3-dihydroquinolin-4-one

8-methyl-1-(pyridine-3-carbonyl)-2,3-dihydroquinolin-4-one (PubChem CID 110635490) has the molecular formula C16H14N2O2 and a molecular weight of 266.30 g/mol. Its IUPAC name is 8-methyl-1-(pyridine-3-carbonyl)-2,3-dihydroquinolin-4-one.

Molecular Properties

Compound Name8-methyl-1-(pyridine-3-carbonyl)-2,3-dihydroquinolin-4-one
PubChem CID110635490
Molecular FormulaC16H14N2O2
Molecular Weight266.30 g/mol
Exact Mass266.11
IUPAC Name8-methyl-1-(pyridine-3-carbonyl)-2,3-dihydroquinolin-4-one
SMILESCc1cccc2c1N(C(=O)c1cccnc1)CCC2=O
InChIInChI=1S/C16H14N2O2/c1-11-4-2-6-13-14(19)7-9-18(15(11)13)16(20)12-5-3-8-17-10-12/h2-6,8,10H,7,9H2,1H3
InChIKeyZPYXILVGYCSHQQ-UHFFFAOYSA-N
XLogP2.62
TPSA50.27 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 52.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

6-methyl-1-(pyridine-3-carbonyl)-2,3-dihydroquinolin-4-one
CID 110634863
1-acetyl-8-methyl-2,3-dihydroquinolin-4-one
CID 110635435
8-methyl-1-(3,4,5-triethoxybenzoyl)-2,3-dihydroquinolin-4-one
CID 110635496
4-[4-(pyridine-3-carbonyl)-1,4-diazepane-1-carbonyl]-2,3-dihydroinden-1-one
CID 135105818
1-(pyridine-3-carbonyl)piperidin-2-one
CID 18935202
1-(pyridine-3-carbonyl)imidazolidin-2-one
CID 57266793
[4-(hydroxymethyl)piperazin-1-yl]-pyridin-3-ylmethanone
CID 71063622
1-(3,4-difluorobenzoyl)-8-methoxy-2,3-dihydroquinolin-4-one
CID 110406834
S-(2-oxoazetidin-1-yl) pyridine-3-carbothioate
CID 158660231
(1-methyl-5,6-dihydro-4H-pyrazolo[5,4-b]pyridin-7-yl)-pyridin-3-ylmethanone
CID 154848941
3-methyl-1-(pyridine-3-carbonyl)piperidin-4-one
CID 114499676
[(3R)-3-(2-methylphenyl)pyrrolidin-1-yl]-pyridin-3-ylmethanone
CID 95292486

Frequently Asked Questions

What is the IUPAC name of 8-methyl-1-(pyridine-3-carbonyl)-2,3-dihydroquinolin-4-one?
The IUPAC name of 8-methyl-1-(pyridine-3-carbonyl)-2,3-dihydroquinolin-4-one (CID 110635490) is 8-methyl-1-(pyridine-3-carbonyl)-2,3-dihydroquinolin-4-one.
What is the SMILES notation for 8-methyl-1-(pyridine-3-carbonyl)-2,3-dihydroquinolin-4-one?
The canonical SMILES for 8-methyl-1-(pyridine-3-carbonyl)-2,3-dihydroquinolin-4-one is Cc1cccc2c1N(C(=O)c1cccnc1)CCC2=O.
What is the InChIKey of 8-methyl-1-(pyridine-3-carbonyl)-2,3-dihydroquinolin-4-one?
The InChIKey is ZPYXILVGYCSHQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O2/c1-11-4-2-6-13-14(19)7-9-18(15(11)13)16(20)12-5-3-8-17-10-12/h2-6,8,10H,7,9H2,1H3.
What are the key properties of 8-methyl-1-(pyridine-3-carbonyl)-2,3-dihydroquinolin-4-one?
8-methyl-1-(pyridine-3-carbonyl)-2,3-dihydroquinolin-4-one has a molecular weight of 266.30 g/mol, XLogP of 2.62, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-1-(pyridine-3-carbonyl)-2,3-dihydroquinolin-4-one is sourced from PubChem (CID 110635490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).