1-(cyclopropanecarbonyl)-6-methyl-2,3-dihydroquinolin-4-one

C14H15NO2 — CID 110634817

IUPAC1-(cyclopropanecarbonyl)-6-methyl-2,3-dihydroquinolin-4-one
SMILESCc1ccc2c(c1)C(=O)CCN2C(=O)C1CC1
InChIInChI=1S/C14H15NO2/c1-9-2-5-12-11(8-9)13(16)6-7-15(12)14(17)10-3-4-10/h2,5,8,10H,3-4,6-7H2,1H3
InChIKeyRQBFWVNJZKUWPY-UHFFFAOYSA-N
MW229.28 g/mol
LogP2.32
Rot. Bonds1

About 1-(cyclopropanecarbonyl)-6-methyl-2,3-dihydroquinolin-4-one

1-(cyclopropanecarbonyl)-6-methyl-2,3-dihydroquinolin-4-one (PubChem CID 110634817) has the molecular formula C14H15NO2 and a molecular weight of 229.28 g/mol. Its IUPAC name is 1-(cyclopropanecarbonyl)-6-methyl-2,3-dihydroquinolin-4-one.

Molecular Properties

Compound Name1-(cyclopropanecarbonyl)-6-methyl-2,3-dihydroquinolin-4-one
PubChem CID110634817
Molecular FormulaC14H15NO2
Molecular Weight229.28 g/mol
Exact Mass229.11
IUPAC Name1-(cyclopropanecarbonyl)-6-methyl-2,3-dihydroquinolin-4-one
SMILESCc1ccc2c(c1)C(=O)CCN2C(=O)C1CC1
InChIInChI=1S/C14H15NO2/c1-9-2-5-12-11(8-9)13(16)6-7-15(12)14(17)10-3-4-10/h2,5,8,10H,3-4,6-7H2,1H3
InChIKeyRQBFWVNJZKUWPY-UHFFFAOYSA-N
XLogP2.32
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(cyclobutanecarbonyl)-6-methoxy-2,3-dihydroquinolin-4-one
CID 110635249
1-(cyclopentanecarbonyl)-6-fluoro-2,3-dihydroquinolin-4-one
CID 110635059
ethyl 6-methyl-4-oxo-2,3-dihydroquinoline-1-carboxylate
CID 110406411
1-(2-ethylbutanoyl)-6-methyl-2,3-dihydroquinolin-4-one
CID 110634824
1-(4-bromobenzoyl)-6-methyl-2,3-dihydroquinolin-4-one
CID 110634836
6-methyl-1-(pyridine-3-carbonyl)-2,3-dihydroquinolin-4-one
CID 110634863
6-methyl-1-(3-phenylpropanoyl)-2,3-dihydroquinolin-4-one
CID 110634848
6-methyl-1-[4-(trifluoromethyl)benzoyl]-2,3-dihydroquinolin-4-one
CID 110634868
6-methyl-1-(3,4,5-trimethoxybenzoyl)-2,3-dihydroquinolin-4-one
CID 110634843
1-(4-aminobenzoyl)-7-methyl-3,4-dihydro-2H-1-benzazepin-5-one
CID 19607937
1-(cyclopropanecarbonyl)-N-(3,5-dimethylphenyl)-2,3-dihydroindole-5-carboxamide
CID 53080907
(2-ethyl-9-methyl-4,5-dihydro-3H-imidazo[4,5-d][1]benzazepin-6-yl)-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]methanone
CID 46898850

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropanecarbonyl)-6-methyl-2,3-dihydroquinolin-4-one?
The IUPAC name of 1-(cyclopropanecarbonyl)-6-methyl-2,3-dihydroquinolin-4-one (CID 110634817) is 1-(cyclopropanecarbonyl)-6-methyl-2,3-dihydroquinolin-4-one.
What is the SMILES notation for 1-(cyclopropanecarbonyl)-6-methyl-2,3-dihydroquinolin-4-one?
The canonical SMILES for 1-(cyclopropanecarbonyl)-6-methyl-2,3-dihydroquinolin-4-one is Cc1ccc2c(c1)C(=O)CCN2C(=O)C1CC1.
What is the InChIKey of 1-(cyclopropanecarbonyl)-6-methyl-2,3-dihydroquinolin-4-one?
The InChIKey is RQBFWVNJZKUWPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO2/c1-9-2-5-12-11(8-9)13(16)6-7-15(12)14(17)10-3-4-10/h2,5,8,10H,3-4,6-7H2,1H3.
What are the key properties of 1-(cyclopropanecarbonyl)-6-methyl-2,3-dihydroquinolin-4-one?
1-(cyclopropanecarbonyl)-6-methyl-2,3-dihydroquinolin-4-one has a molecular weight of 229.28 g/mol, XLogP of 2.32, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropanecarbonyl)-6-methyl-2,3-dihydroquinolin-4-one is sourced from PubChem (CID 110634817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).