2-(cyclopentylmethoxy)-1-(4-ethylphenyl)propan-1-one

C17H24O2 — CID 66322866

IUPAC2-(cyclopentylmethoxy)-1-(4-ethylphenyl)propan-1-one
SMILESCCc1ccc(C(=O)C(C)OCC2CCCC2)cc1
InChIInChI=1S/C17H24O2/c1-3-14-8-10-16(11-9-14)17(18)13(2)19-12-15-6-4-5-7-15/h8-11,13,15H,3-7,12H2,1-2H3
InChIKeyYDOABAUAJGEWPX-UHFFFAOYSA-N
MW260.38 g/mol
LogP4.03
Rot. Bonds6

About 2-(cyclopentylmethoxy)-1-(4-ethylphenyl)propan-1-one

2-(cyclopentylmethoxy)-1-(4-ethylphenyl)propan-1-one (PubChem CID 66322866) has the molecular formula C17H24O2 and a molecular weight of 260.38 g/mol. Its IUPAC name is 2-(cyclopentylmethoxy)-1-(4-ethylphenyl)propan-1-one.

Molecular Properties

Compound Name2-(cyclopentylmethoxy)-1-(4-ethylphenyl)propan-1-one
PubChem CID66322866
Molecular FormulaC17H24O2
Molecular Weight260.38 g/mol
Exact Mass260.18
IUPAC Name2-(cyclopentylmethoxy)-1-(4-ethylphenyl)propan-1-one
SMILESCCc1ccc(C(=O)C(C)OCC2CCCC2)cc1
InChIInChI=1S/C17H24O2/c1-3-14-8-10-16(11-9-14)17(18)13(2)19-12-15-6-4-5-7-15/h8-11,13,15H,3-7,12H2,1-2H3
InChIKeyYDOABAUAJGEWPX-UHFFFAOYSA-N
XLogP4.03
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 54.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-ethoxy-1-(4-ethylphenyl)propan-1-one
CID 43799619
2-cyclobutyloxy-1-(4-ethylphenyl)propan-1-one
CID 62142171
2-(2,2-difluoroethoxy)-1-(4-ethylphenyl)propan-1-one
CID 82006429
2-(cyclopentylamino)-1-(4-ethylphenyl)propan-1-one
CID 82100230
1-(4-ethylphenyl)-2-(3,3,3-trifluoropropoxy)propan-1-one
CID 82955506
2-(cyclopentylmethoxy)propanoic acid
CID 66322360
1-(5-chlorothiophen-2-yl)-2-(cyclohexylmethoxy)propan-1-one
CID 62381541
(2R)-2-(cyclohexylmethoxy)pentan-3-one
CID 163532136
2-[cyclopropyl(ethyl)amino]-1-(4-ethylphenyl)propan-1-one
CID 43794990
methyl 5-[1-(cyclopentylmethoxy)ethyl]furan-2-carboxylate
CID 79083634
2-cyclopropyl-1-(4-ethylphenyl)-2-hydroxyethanone
CID 103455896
4-O-[(2R)-1-(4-ethylphenyl)-1-oxopropan-2-yl] 1-O-methyl benzene-1,4-dicarboxylate
CID 7239598

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopentylmethoxy)-1-(4-ethylphenyl)propan-1-one?
The IUPAC name of 2-(cyclopentylmethoxy)-1-(4-ethylphenyl)propan-1-one (CID 66322866) is 2-(cyclopentylmethoxy)-1-(4-ethylphenyl)propan-1-one.
What is the SMILES notation for 2-(cyclopentylmethoxy)-1-(4-ethylphenyl)propan-1-one?
The canonical SMILES for 2-(cyclopentylmethoxy)-1-(4-ethylphenyl)propan-1-one is CCc1ccc(C(=O)C(C)OCC2CCCC2)cc1.
What is the InChIKey of 2-(cyclopentylmethoxy)-1-(4-ethylphenyl)propan-1-one?
The InChIKey is YDOABAUAJGEWPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24O2/c1-3-14-8-10-16(11-9-14)17(18)13(2)19-12-15-6-4-5-7-15/h8-11,13,15H,3-7,12H2,1-2H3.
What are the key properties of 2-(cyclopentylmethoxy)-1-(4-ethylphenyl)propan-1-one?
2-(cyclopentylmethoxy)-1-(4-ethylphenyl)propan-1-one has a molecular weight of 260.38 g/mol, XLogP of 4.03, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopentylmethoxy)-1-(4-ethylphenyl)propan-1-one is sourced from PubChem (CID 66322866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).