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

C15H17NO2 — CID 82293701

IUPAC1-methyl-6-(1-methylcyclopropanecarbonyl)-3,4-dihydroquinolin-2-one
SMILESCN1C(=O)CCc2cc(C(=O)C3(C)CC3)ccc21
InChIInChI=1S/C15H17NO2/c1-15(7-8-15)14(18)11-3-5-12-10(9-11)4-6-13(17)16(12)2/h3,5,9H,4,6-8H2,1-2H3
InChIKeyJKPDPTLUBTUWNJ-UHFFFAOYSA-N
MW243.31 g/mol
LogP2.58
Rot. Bonds2

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

1-methyl-6-(1-methylcyclopropanecarbonyl)-3,4-dihydroquinolin-2-one (PubChem CID 82293701) has the molecular formula C15H17NO2 and a molecular weight of 243.31 g/mol. Its IUPAC name is 1-methyl-6-(1-methylcyclopropanecarbonyl)-3,4-dihydroquinolin-2-one.

Molecular Properties

Compound Name1-methyl-6-(1-methylcyclopropanecarbonyl)-3,4-dihydroquinolin-2-one
PubChem CID82293701
Molecular FormulaC15H17NO2
Molecular Weight243.31 g/mol
Exact Mass243.13
IUPAC Name1-methyl-6-(1-methylcyclopropanecarbonyl)-3,4-dihydroquinolin-2-one
SMILESCN1C(=O)CCc2cc(C(=O)C3(C)CC3)ccc21
InChIInChI=1S/C15H17NO2/c1-15(7-8-15)14(18)11-3-5-12-10(9-11)4-6-13(17)16(12)2/h3,5,9H,4,6-8H2,1-2H3
InChIKeyJKPDPTLUBTUWNJ-UHFFFAOYSA-N
XLogP2.58
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 52.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

6-[1-(hydroxymethyl)cyclopropanecarbonyl]-1-methyl-3,4-dihydroquinolin-2-one
CID 116921112
1-methyl-6-prop-2-enoyl-3,4-dihydroquinolin-2-one
CID 82284659
3-bromo-1-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)propane-1,2-dione
CID 116822726
6-(4-bromobenzoyl)-1-methyl-3,4-dihydroquinolin-2-one
CID 63096081
1-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)butane-1,3-dione
CID 82294637
1-[(1-methyl-2-oxo-3,4-dihydroquinoline-6-carbonyl)amino]cyclobutane-1-carboxylic acid
CID 120530960
1-methyl-6-(piperidine-1-carbonyl)-3,4-dihydroquinolin-2-one
CID 52986183
4-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)-4-oxobut-2-enoic acid
CID 77054964
6-(2-iodobenzoyl)-1-methyl-3,4-dihydroquinolin-2-one
CID 63096091
1-methyl-6-(3-methylthiophene-2-carbonyl)-3,4-dihydroquinolin-2-one
CID 63097473
1-[(1-methyl-2-oxo-3,4-dihydroquinoline-6-carbonyl)amino]cyclohexane-1-carboxylic acid
CID 120512742
6-(3-bromothiophene-2-carbonyl)-1-methyl-3,4-dihydroquinolin-2-one
CID 63796681

Frequently Asked Questions

What is the IUPAC name of 1-methyl-6-(1-methylcyclopropanecarbonyl)-3,4-dihydroquinolin-2-one?
The IUPAC name of 1-methyl-6-(1-methylcyclopropanecarbonyl)-3,4-dihydroquinolin-2-one (CID 82293701) is 1-methyl-6-(1-methylcyclopropanecarbonyl)-3,4-dihydroquinolin-2-one.
What is the SMILES notation for 1-methyl-6-(1-methylcyclopropanecarbonyl)-3,4-dihydroquinolin-2-one?
The canonical SMILES for 1-methyl-6-(1-methylcyclopropanecarbonyl)-3,4-dihydroquinolin-2-one is CN1C(=O)CCc2cc(C(=O)C3(C)CC3)ccc21.
What is the InChIKey of 1-methyl-6-(1-methylcyclopropanecarbonyl)-3,4-dihydroquinolin-2-one?
The InChIKey is JKPDPTLUBTUWNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO2/c1-15(7-8-15)14(18)11-3-5-12-10(9-11)4-6-13(17)16(12)2/h3,5,9H,4,6-8H2,1-2H3.
What are the key properties of 1-methyl-6-(1-methylcyclopropanecarbonyl)-3,4-dihydroquinolin-2-one?
1-methyl-6-(1-methylcyclopropanecarbonyl)-3,4-dihydroquinolin-2-one has a molecular weight of 243.31 g/mol, XLogP of 2.58, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-6-(1-methylcyclopropanecarbonyl)-3,4-dihydroquinolin-2-one is sourced from PubChem (CID 82293701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).