1-(1-phenylcyclopentyl)propan-1-one

C14H18O — CID 63080096

IUPAC1-(1-phenylcyclopentyl)propan-1-one
SMILESCCC(=O)C1(c2ccccc2)CCCC1
InChIInChI=1S/C14H18O/c1-2-13(15)14(10-6-7-11-14)12-8-4-3-5-9-12/h3-5,8-9H,2,6-7,10-11H2,1H3
InChIKeyLSZKAXKSDOMJTH-UHFFFAOYSA-N
MW202.30 g/mol
LogP3.48
Rot. Bonds3

About 1-(1-phenylcyclopentyl)propan-1-one

1-(1-phenylcyclopentyl)propan-1-one (PubChem CID 63080096) has the molecular formula C14H18O and a molecular weight of 202.30 g/mol. Its IUPAC name is 1-(1-phenylcyclopentyl)propan-1-one.

Molecular Properties

Compound Name1-(1-phenylcyclopentyl)propan-1-one
PubChem CID63080096
Molecular FormulaC14H18O
Molecular Weight202.30 g/mol
Exact Mass202.14
IUPAC Name1-(1-phenylcyclopentyl)propan-1-one
SMILESCCC(=O)C1(c2ccccc2)CCCC1
InChIInChI=1S/C14H18O/c1-2-13(15)14(10-6-7-11-14)12-8-4-3-5-9-12/h3-5,8-9H,2,6-7,10-11H2,1H3
InChIKeyLSZKAXKSDOMJTH-UHFFFAOYSA-N
XLogP3.48
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 53.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-ethoxy-1-(1-phenylcyclopentyl)ethanone
CID 79567147
3-methyl-1-(1-phenylcyclopentyl)pentan-1-one
CID 55179619
2-methoxy-1-(1-phenylcyclohexyl)ethanone
CID 79567283
4-methyl-1-(1-phenylcyclopentyl)pent-4-en-1-one
CID 114473546
2-(diethylamino)-1-(1-phenylcyclobutyl)ethanone
CID 130330381
3-methyl-1-(1-phenylcyclopentyl)hexan-1-one
CID 63410458
[2-oxo-2-(1-phenylcyclopentyl)ethyl]phosphonic acid
CID 69250269
N-ethyl-1-phenylcyclopentane-1-carboxamide
CID 778764
1-(1-naphthalen-2-ylcyclobutyl)propan-1-one
CID 174403861
1-(1-phenylcyclobutyl)pent-3-yn-1-one
CID 63078433
2-(3-methylphenyl)-1-(1-phenylcyclopentyl)ethanone
CID 63410082
(4-ethylphenyl)-(1-phenylcyclopentyl)methanone
CID 63410201

Frequently Asked Questions

What is the IUPAC name of 1-(1-phenylcyclopentyl)propan-1-one?
The IUPAC name of 1-(1-phenylcyclopentyl)propan-1-one (CID 63080096) is 1-(1-phenylcyclopentyl)propan-1-one.
What is the SMILES notation for 1-(1-phenylcyclopentyl)propan-1-one?
The canonical SMILES for 1-(1-phenylcyclopentyl)propan-1-one is CCC(=O)C1(c2ccccc2)CCCC1.
What is the InChIKey of 1-(1-phenylcyclopentyl)propan-1-one?
The InChIKey is LSZKAXKSDOMJTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18O/c1-2-13(15)14(10-6-7-11-14)12-8-4-3-5-9-12/h3-5,8-9H,2,6-7,10-11H2,1H3.
What are the key properties of 1-(1-phenylcyclopentyl)propan-1-one?
1-(1-phenylcyclopentyl)propan-1-one has a molecular weight of 202.30 g/mol, XLogP of 3.48, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-phenylcyclopentyl)propan-1-one is sourced from PubChem (CID 63080096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).