5-(4-fluorocyclohexyl)pyrrolidin-2-one

C10H16FNO — CID 68848959

IUPAC5-(4-fluorocyclohexyl)pyrrolidin-2-one
SMILESO=C1CCC(C2CCC(F)CC2)N1
InChIInChI=1S/C10H16FNO/c11-8-3-1-7(2-4-8)9-5-6-10(13)12-9/h7-9H,1-6H2,(H,12,13)
InChIKeyYYNVKLFBWSUBKK-UHFFFAOYSA-N
MW185.24 g/mol
LogP1.79
Rot. Bonds1

About 5-(4-fluorocyclohexyl)pyrrolidin-2-one

5-(4-fluorocyclohexyl)pyrrolidin-2-one (PubChem CID 68848959) has the molecular formula C10H16FNO and a molecular weight of 185.24 g/mol. Its IUPAC name is 5-(4-fluorocyclohexyl)pyrrolidin-2-one.

Molecular Properties

Compound Name5-(4-fluorocyclohexyl)pyrrolidin-2-one
PubChem CID68848959
Molecular FormulaC10H16FNO
Molecular Weight185.24 g/mol
Exact Mass185.12
IUPAC Name5-(4-fluorocyclohexyl)pyrrolidin-2-one
SMILESO=C1CCC(C2CCC(F)CC2)N1
InChIInChI=1S/C10H16FNO/c11-8-3-1-7(2-4-8)9-5-6-10(13)12-9/h7-9H,1-6H2,(H,12,13)
InChIKeyYYNVKLFBWSUBKK-UHFFFAOYSA-N
XLogP1.79
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.24
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 5-(4-fluorocyclohexyl)pyrrolidin-2-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

2-Azaspiro(4.5)decan-3-one
CID 47457
(2S)-2-amino-2-cyclohexyl-1-(pyrrolidin-1-yl)ethan-1-one
CID 23646031
N,3-dicyclohexylpropanamide
CID 759108
N-cyclohexylcyclohexaneacetamide
CID 880907
(S)-2-amino-2-cyclohexyl-1-(3,3,4,4-tetrafluoropyrrolidin-1-yl)ethanone
CID 9838664
(2S)-2-amino-2-cyclohexyl-1-(3-fluoropyrrolidin-1-yl)ethanone
CID 10220206
(S)-2-Amino-2-cyclohexyl-1-((S)-3-fluoro-pyrrolidin-1-yl)-ethanone
CID 44458594
(S)-2-Amino-2-cyclohexyl-1-((R)-3-fluoro-pyrrolidin-1-yl)-ethanone
CID 44458603
(S)-2-Amino-2-cyclohexyl-1-(3,3-difluoro-pyrrolidin-1-yl)-ethanone
CID 44458617
rel-(3aR,7aR)-Octahydro-2H-indol-2-one
CID 10887991
N-cyclohexyl-3-cyclopentylpropanamide
CID 835664
(S)-2-Amino-2-cyclohexyl-1-((3R,4R)-3,4-difluoro-pyrrolidin-1-yl)-ethanone
CID 44402967

Frequently Asked Questions

What is the IUPAC name of 5-(4-fluorocyclohexyl)pyrrolidin-2-one?
The IUPAC name of 5-(4-fluorocyclohexyl)pyrrolidin-2-one (CID 68848959) is 5-(4-fluorocyclohexyl)pyrrolidin-2-one.
What is the SMILES notation for 5-(4-fluorocyclohexyl)pyrrolidin-2-one?
The canonical SMILES for 5-(4-fluorocyclohexyl)pyrrolidin-2-one is O=C1CCC(C2CCC(F)CC2)N1.
What is the InChIKey of 5-(4-fluorocyclohexyl)pyrrolidin-2-one?
The InChIKey is YYNVKLFBWSUBKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16FNO/c11-8-3-1-7(2-4-8)9-5-6-10(13)12-9/h7-9H,1-6H2,(H,12,13).
What are the key properties of 5-(4-fluorocyclohexyl)pyrrolidin-2-one?
5-(4-fluorocyclohexyl)pyrrolidin-2-one has a molecular weight of 185.24 g/mol, XLogP of 1.79, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-fluorocyclohexyl)pyrrolidin-2-one is sourced from PubChem (CID 68848959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).