7-cyclopentyloxy-1-methyl-6-pyridin-3-yl-3,4-dihydroquinolin-2-one

C20H22N2O2 — CID 66559936

IUPAC7-cyclopentyloxy-1-methyl-6-pyridin-3-yl-3,4-dihydroquinolin-2-one
SMILESCN1C(=O)CCc2cc(-c3cccnc3)c(OC3CCCC3)cc21
InChIInChI=1S/C20H22N2O2/c1-22-18-12-19(24-16-6-2-3-7-16)17(15-5-4-10-21-13-15)11-14(18)8-9-20(22)23/h4-5,10-13,16H,2-3,6-9H2,1H3
InChIKeyMOIMUBVZESBJEH-UHFFFAOYSA-N
MW322.41 g/mol
LogP3.98
Rot. Bonds3

About 7-cyclopentyloxy-1-methyl-6-pyridin-3-yl-3,4-dihydroquinolin-2-one

7-cyclopentyloxy-1-methyl-6-pyridin-3-yl-3,4-dihydroquinolin-2-one (PubChem CID 66559936) has the molecular formula C20H22N2O2 and a molecular weight of 322.41 g/mol. Its IUPAC name is 7-cyclopentyloxy-1-methyl-6-pyridin-3-yl-3,4-dihydroquinolin-2-one.

Molecular Properties

Compound Name7-cyclopentyloxy-1-methyl-6-pyridin-3-yl-3,4-dihydroquinolin-2-one
PubChem CID66559936
Molecular FormulaC20H22N2O2
Molecular Weight322.41 g/mol
Exact Mass322.17
IUPAC Name7-cyclopentyloxy-1-methyl-6-pyridin-3-yl-3,4-dihydroquinolin-2-one
SMILESCN1C(=O)CCc2cc(-c3cccnc3)c(OC3CCCC3)cc21
InChIInChI=1S/C20H22N2O2/c1-22-18-12-19(24-16-6-2-3-7-16)17(15-5-4-10-21-13-15)11-14(18)8-9-20(22)23/h4-5,10-13,16H,2-3,6-9H2,1H3
InChIKeyMOIMUBVZESBJEH-UHFFFAOYSA-N
XLogP3.98
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.41
LogP ≤ 53.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

6-(5-methoxypyridin-3-yl)-1-methyl-3,4-dihydroquinolin-2(1H)-one
CID 25180503
6-(5-Ethoxy-3-pyridinyl)-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-11-one
CID 44479643
(S)-8-((2-amino-4-methylpentyl)oxy)-4,6-dimethyl-5-oxo-5,6-dihydrobenzo[c][2,7]naphthyridine-9-carbonitrile
CID 73214233
6-(5-Propan-2-yloxy-3-pyridinyl)-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-11-one
CID 44479883
6-[5-(4-Methoxyphenyl)-3-pyridinyl]-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-11-one
CID 44480128
6-[5-(3-Methoxyphenyl)-3-pyridinyl]-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-11-one
CID 44480129
6-[5-(2-Methoxyphenyl)-3-pyridinyl]-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-11-one
CID 44480134
7-ethoxy-6-pyridin-3-yl-3,4-dihydro-1H-quinolin-2-one
CID 58255415
7-hydroxy-6-pyridin-3-yl-3,4,4a,8a-tetrahydro-1H-quinolin-2-one
CID 58255482
7-methoxy-6-pyridin-3-yl-3,4-dihydro-1H-quinolin-2-one
CID 58255581
US9663529, Example I-9
CID 90466675
US9663529, Example I-6
CID 90467701

Frequently Asked Questions

What is the IUPAC name of 7-cyclopentyloxy-1-methyl-6-pyridin-3-yl-3,4-dihydroquinolin-2-one?
The IUPAC name of 7-cyclopentyloxy-1-methyl-6-pyridin-3-yl-3,4-dihydroquinolin-2-one (CID 66559936) is 7-cyclopentyloxy-1-methyl-6-pyridin-3-yl-3,4-dihydroquinolin-2-one.
What is the SMILES notation for 7-cyclopentyloxy-1-methyl-6-pyridin-3-yl-3,4-dihydroquinolin-2-one?
The canonical SMILES for 7-cyclopentyloxy-1-methyl-6-pyridin-3-yl-3,4-dihydroquinolin-2-one is CN1C(=O)CCc2cc(-c3cccnc3)c(OC3CCCC3)cc21.
What is the InChIKey of 7-cyclopentyloxy-1-methyl-6-pyridin-3-yl-3,4-dihydroquinolin-2-one?
The InChIKey is MOIMUBVZESBJEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O2/c1-22-18-12-19(24-16-6-2-3-7-16)17(15-5-4-10-21-13-15)11-14(18)8-9-20(22)23/h4-5,10-13,16H,2-3,6-9H2,1H3.
What are the key properties of 7-cyclopentyloxy-1-methyl-6-pyridin-3-yl-3,4-dihydroquinolin-2-one?
7-cyclopentyloxy-1-methyl-6-pyridin-3-yl-3,4-dihydroquinolin-2-one has a molecular weight of 322.41 g/mol, XLogP of 3.98, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-cyclopentyloxy-1-methyl-6-pyridin-3-yl-3,4-dihydroquinolin-2-one is sourced from PubChem (CID 66559936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).