1-[1-(diethylamino)cyclopentyl]propan-1-one

C12H23NO — CID 79070006

IUPAC1-[1-(diethylamino)cyclopentyl]propan-1-one
SMILESCCC(=O)C1(N(CC)CC)CCCC1
InChIInChI=1S/C12H23NO/c1-4-11(14)12(9-7-8-10-12)13(5-2)6-3/h4-10H2,1-3H3
InChIKeyYYOJPNVQIPTNLB-UHFFFAOYSA-N
MW197.32 g/mol
LogP2.62
Rot. Bonds5

About 1-[1-(diethylamino)cyclopentyl]propan-1-one

1-[1-(diethylamino)cyclopentyl]propan-1-one (PubChem CID 79070006) has the molecular formula C12H23NO and a molecular weight of 197.32 g/mol. Its IUPAC name is 1-[1-(diethylamino)cyclopentyl]propan-1-one.

Molecular Properties

Compound Name1-[1-(diethylamino)cyclopentyl]propan-1-one
PubChem CID79070006
Molecular FormulaC12H23NO
Molecular Weight197.32 g/mol
Exact Mass197.18
IUPAC Name1-[1-(diethylamino)cyclopentyl]propan-1-one
SMILESCCC(=O)C1(N(CC)CC)CCCC1
InChIInChI=1S/C12H23NO/c1-4-11(14)12(9-7-8-10-12)13(5-2)6-3/h4-10H2,1-3H3
InChIKeyYYOJPNVQIPTNLB-UHFFFAOYSA-N
XLogP2.62
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.32
LogP ≤ 52.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-[1-(diethylamino)cyclopentyl]propan-1-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[1-[ethyl(methyl)amino]cyclopentyl]propan-1-one
CID 145420039
1-(diethylamino)cyclododecane-1-carboxylic acid
CID 43803612
1-(diethylamino)cycloheptane-1-carboxylic acid
CID 43803613
1-(diethylamino)cyclohexane-1-carboxamide
CID 16762798
1-[1-(diethylamino)cyclopentyl]-2-(2-methoxyphenyl)ethanone
CID 79058681
[1-(diethylamino)cyclopentyl]-(3,5-dimethylcyclohexyl)methanone
CID 79069711
2-(3-bromothiophen-2-yl)-1-[1-(diethylamino)cyclopentyl]ethanone
CID 79070320
1-[1-(diethylamino)cyclopentyl]-2-(5-fluoro-2-methylphenyl)ethanone
CID 105373297
[1-(diethylamino)cyclopentyl]-(oxan-4-yl)methanone
CID 79070861
2-(3-chloro-4-pyridinyl)-1-[1-(diethylamino)cyclopentyl]ethanone
CID 79070162
(3-chloro-4-methylphenyl)-[1-(diethylamino)cyclopentyl]methanone
CID 107559882
2-(2-amino-4-pyridinyl)-1-[1-(diethylamino)cyclopentyl]ethanone
CID 79070163

Frequently Asked Questions

What is the IUPAC name of 1-[1-(diethylamino)cyclopentyl]propan-1-one?
The IUPAC name of 1-[1-(diethylamino)cyclopentyl]propan-1-one (CID 79070006) is 1-[1-(diethylamino)cyclopentyl]propan-1-one.
What is the SMILES notation for 1-[1-(diethylamino)cyclopentyl]propan-1-one?
The canonical SMILES for 1-[1-(diethylamino)cyclopentyl]propan-1-one is CCC(=O)C1(N(CC)CC)CCCC1.
What is the InChIKey of 1-[1-(diethylamino)cyclopentyl]propan-1-one?
The InChIKey is YYOJPNVQIPTNLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO/c1-4-11(14)12(9-7-8-10-12)13(5-2)6-3/h4-10H2,1-3H3.
What are the key properties of 1-[1-(diethylamino)cyclopentyl]propan-1-one?
1-[1-(diethylamino)cyclopentyl]propan-1-one has a molecular weight of 197.32 g/mol, XLogP of 2.62, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(diethylamino)cyclopentyl]propan-1-one is sourced from PubChem (CID 79070006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).