1-(1-methoxycyclopentyl)-2-quinolin-2-ylethanone

C17H19NO2 — CID 104610088

IUPAC1-(1-methoxycyclopentyl)-2-quinolin-2-ylethanone
SMILESCOC1(C(=O)Cc2ccc3ccccc3n2)CCCC1
InChIInChI=1S/C17H19NO2/c1-20-17(10-4-5-11-17)16(19)12-14-9-8-13-6-2-3-7-15(13)18-14/h2-3,6-9H,4-5,10-12H2,1H3
InChIKeyJUOLVGXHWDPYEI-UHFFFAOYSA-N
MW269.34 g/mol
LogP3.31
Rot. Bonds4

About 1-(1-methoxycyclopentyl)-2-quinolin-2-ylethanone

1-(1-methoxycyclopentyl)-2-quinolin-2-ylethanone (PubChem CID 104610088) has the molecular formula C17H19NO2 and a molecular weight of 269.34 g/mol. Its IUPAC name is 1-(1-methoxycyclopentyl)-2-quinolin-2-ylethanone.

Molecular Properties

Compound Name1-(1-methoxycyclopentyl)-2-quinolin-2-ylethanone
PubChem CID104610088
Molecular FormulaC17H19NO2
Molecular Weight269.34 g/mol
Exact Mass269.14
IUPAC Name1-(1-methoxycyclopentyl)-2-quinolin-2-ylethanone
SMILESCOC1(C(=O)Cc2ccc3ccccc3n2)CCCC1
InChIInChI=1S/C17H19NO2/c1-20-17(10-4-5-11-17)16(19)12-14-9-8-13-6-2-3-7-15(13)18-14/h2-3,6-9H,4-5,10-12H2,1H3
InChIKeyJUOLVGXHWDPYEI-UHFFFAOYSA-N
XLogP3.31
TPSA39.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.34
LogP ≤ 53.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1,3-benzothiazol-2-yl)-1-(1-methoxycyclopentyl)ethanone
CID 104610095
1-(3-aminooxolan-3-yl)-2-quinolin-2-ylethanone
CID 116579737
1-(1-aminocyclobutyl)-3-quinolin-2-ylpropan-2-one
CID 116591404
1-(4-aminooxan-4-yl)-2-quinolin-2-ylethanone
CID 116604768
4-methoxy-1-quinolin-2-ylbutan-2-one
CID 43139081
1-(quinolin-2-ylmethyl)cyclopentane-1-carboxylic acid
CID 79425688
1-(1-methoxycyclopentyl)-2-pyridin-4-ylethanone
CID 104610156
2-quinolin-2-ylacetic acid;hydrate
CID 141421012
1-(quinolin-2-ylmethyl)cyclohexane-1-carboxylic acid
CID 79425020
methyl 2-[methyl-(2-quinolin-2-ylacetyl)amino]acetate
CID 110464188
methyl 1-[4-(quinolin-2-ylmethoxy)phenyl]cyclopentane-1-carboxylate
CID 15052569
N-cyclohexyl-2-quinolin-2-ylacetamide
CID 110464171

Frequently Asked Questions

What is the IUPAC name of 1-(1-methoxycyclopentyl)-2-quinolin-2-ylethanone?
The IUPAC name of 1-(1-methoxycyclopentyl)-2-quinolin-2-ylethanone (CID 104610088) is 1-(1-methoxycyclopentyl)-2-quinolin-2-ylethanone.
What is the SMILES notation for 1-(1-methoxycyclopentyl)-2-quinolin-2-ylethanone?
The canonical SMILES for 1-(1-methoxycyclopentyl)-2-quinolin-2-ylethanone is COC1(C(=O)Cc2ccc3ccccc3n2)CCCC1.
What is the InChIKey of 1-(1-methoxycyclopentyl)-2-quinolin-2-ylethanone?
The InChIKey is JUOLVGXHWDPYEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO2/c1-20-17(10-4-5-11-17)16(19)12-14-9-8-13-6-2-3-7-15(13)18-14/h2-3,6-9H,4-5,10-12H2,1H3.
What are the key properties of 1-(1-methoxycyclopentyl)-2-quinolin-2-ylethanone?
1-(1-methoxycyclopentyl)-2-quinolin-2-ylethanone has a molecular weight of 269.34 g/mol, XLogP of 3.31, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methoxycyclopentyl)-2-quinolin-2-ylethanone is sourced from PubChem (CID 104610088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).