cyclopentyl-(7-methoxy-3-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone

C17H23NO2 — CID 110662971

IUPACcyclopentyl-(7-methoxy-3-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone
SMILESCOc1ccc2c(c1)N(C(=O)C1CCCC1)CC(C)C2
InChIInChI=1S/C17H23NO2/c1-12-9-14-7-8-15(20-2)10-16(14)18(11-12)17(19)13-5-3-4-6-13/h7-8,10,12-13H,3-6,9,11H2,1-2H3
InChIKeyIUVJUYNNJSRQPA-UHFFFAOYSA-N
MW273.38 g/mol
LogP3.41
Rot. Bonds2

About cyclopentyl-(7-methoxy-3-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone

cyclopentyl-(7-methoxy-3-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone (PubChem CID 110662971) has the molecular formula C17H23NO2 and a molecular weight of 273.38 g/mol. Its IUPAC name is cyclopentyl-(7-methoxy-3-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone.

Molecular Properties

Compound Namecyclopentyl-(7-methoxy-3-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone
PubChem CID110662971
Molecular FormulaC17H23NO2
Molecular Weight273.38 g/mol
Exact Mass273.17
IUPAC Namecyclopentyl-(7-methoxy-3-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone
SMILESCOc1ccc2c(c1)N(C(=O)C1CCCC1)CC(C)C2
InChIInChI=1S/C17H23NO2/c1-12-9-14-7-8-15(20-2)10-16(14)18(11-12)17(19)13-5-3-4-6-13/h7-8,10,12-13H,3-6,9,11H2,1-2H3
InChIKeyIUVJUYNNJSRQPA-UHFFFAOYSA-N
XLogP3.41
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.38
LogP ≤ 53.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(7-methoxy-3-methyl-3,4-dihydro-2H-quinolin-1-yl)-2-methylpropan-1-one
CID 110662965
1-(7-methoxy-3-methyl-3,4-dihydro-2H-quinolin-1-yl)-2-(3-methoxyphenyl)ethanone
CID 110662993
(7-methoxy-3-methyl-3,4-dihydro-2H-quinolin-1-yl)-pyridin-3-ylmethanone
CID 110662984
1-(7-methoxy-3-methyl-3,4-dihydro-2H-quinolin-1-yl)-2-phenoxyethanone
CID 110662982
1,3-benzodioxol-5-yl-(7-methoxy-3-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone
CID 110662954
cyclobutyl-(4-hydroxy-7-methoxy-3,4-dihydro-2H-quinolin-1-yl)methanone
CID 110637163
6-methoxy-2-(3-methylpiperidine-1-carbonyl)-2,3-dihydroindole-1-carboxylic acid
CID 69273581
N-[4-[(7-methoxy-3-methyl-3,4-dihydro-2H-quinolin-1-yl)sulfonyl]phenyl]acetamide
CID 110663008
6-methoxy-3-methyl-N-propyl-3,4-dihydro-2H-quinoline-1-carboxamide
CID 110663101
1-(benzenesulfonyl)-7-methoxy-3-methyl-3,4-dihydro-2H-quinoline
CID 110663002
furan-2-yl-(6-methoxy-3-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone
CID 110663052
1-(cyclobutanecarbonyl)-6-methoxy-2,3-dihydroquinolin-4-one
CID 110635249

Frequently Asked Questions

What is the IUPAC name of cyclopentyl-(7-methoxy-3-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone?
The IUPAC name of cyclopentyl-(7-methoxy-3-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone (CID 110662971) is cyclopentyl-(7-methoxy-3-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone.
What is the SMILES notation for cyclopentyl-(7-methoxy-3-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone?
The canonical SMILES for cyclopentyl-(7-methoxy-3-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone is COc1ccc2c(c1)N(C(=O)C1CCCC1)CC(C)C2.
What is the InChIKey of cyclopentyl-(7-methoxy-3-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone?
The InChIKey is IUVJUYNNJSRQPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23NO2/c1-12-9-14-7-8-15(20-2)10-16(14)18(11-12)17(19)13-5-3-4-6-13/h7-8,10,12-13H,3-6,9,11H2,1-2H3.
What are the key properties of cyclopentyl-(7-methoxy-3-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone?
cyclopentyl-(7-methoxy-3-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone has a molecular weight of 273.38 g/mol, XLogP of 3.41, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentyl-(7-methoxy-3-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone is sourced from PubChem (CID 110662971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).