cis-(1R,2S)-2-fluoro-N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclopentyl]cyclohexane-1-sulfonamide

C14H22FN3O3S — CID 154810650

IUPACcis-(1R,2S)-2-fluoro-N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclopentyl]cyclohexane-1-sulfonamide
SMILESCc1nc(C2(NS(=O)(=O)[C@@H]3CCCC[C@@H]3F)CCCC2)no1
InChIInChI=1S/C14H22FN3O3S/c1-10-16-13(17-21-10)14(8-4-5-9-14)18-22(19,20)12-7-3-2-6-11(12)15/h11-12,18H,2-9H2,1H3/t11-,12+/m0/s1
InChIKeyKZZNNEQBZKCARZ-NWDGAFQWSA-N
MW331.41 g/mol
LogP2.35
Rot. Bonds4

About cis-(1R,2S)-2-fluoro-N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclopentyl]cyclohexane-1-sulfonamide

cis-(1R,2S)-2-fluoro-N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclopentyl]cyclohexane-1-sulfonamide (PubChem CID 154810650) has the molecular formula C14H22FN3O3S and a molecular weight of 331.41 g/mol. Its IUPAC name is cis-(1R,2S)-2-fluoro-N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclopentyl]cyclohexane-1-sulfonamide.

Molecular Properties

Compound Namecis-(1R,2S)-2-fluoro-N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclopentyl]cyclohexane-1-sulfonamide
PubChem CID154810650
Molecular FormulaC14H22FN3O3S
Molecular Weight331.41 g/mol
Exact Mass331.14
IUPAC Namecis-(1R,2S)-2-fluoro-N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclopentyl]cyclohexane-1-sulfonamide
SMILESCc1nc(C2(NS(=O)(=O)[C@@H]3CCCC[C@@H]3F)CCCC2)no1
InChIInChI=1S/C14H22FN3O3S/c1-10-16-13(17-21-10)14(8-4-5-9-14)18-22(19,20)12-7-3-2-6-11(12)15/h11-12,18H,2-9H2,1H3/t11-,12+/m0/s1
InChIKeyKZZNNEQBZKCARZ-NWDGAFQWSA-N
XLogP2.35
TPSA85.09 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.41
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze cis-(1R,2S)-2-fluoro-N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclopentyl]cyclohexane-1-sulfonamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of cis-(1R,2S)-2-fluoro-N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclopentyl]cyclohexane-1-sulfonamide?
The IUPAC name of cis-(1R,2S)-2-fluoro-N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclopentyl]cyclohexane-1-sulfonamide (CID 154810650) is cis-(1R,2S)-2-fluoro-N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclopentyl]cyclohexane-1-sulfonamide.
What is the SMILES notation for cis-(1R,2S)-2-fluoro-N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclopentyl]cyclohexane-1-sulfonamide?
The canonical SMILES for cis-(1R,2S)-2-fluoro-N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclopentyl]cyclohexane-1-sulfonamide is Cc1nc(C2(NS(=O)(=O)[C@@H]3CCCC[C@@H]3F)CCCC2)no1.
What is the InChIKey of cis-(1R,2S)-2-fluoro-N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclopentyl]cyclohexane-1-sulfonamide?
The InChIKey is KZZNNEQBZKCARZ-NWDGAFQWSA-N. The full InChI is InChI=1S/C14H22FN3O3S/c1-10-16-13(17-21-10)14(8-4-5-9-14)18-22(19,20)12-7-3-2-6-11(12)15/h11-12,18H,2-9H2,1H3/t11-,12+/m0/s1.
What are the key properties of cis-(1R,2S)-2-fluoro-N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclopentyl]cyclohexane-1-sulfonamide?
cis-(1R,2S)-2-fluoro-N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclopentyl]cyclohexane-1-sulfonamide has a molecular weight of 331.41 g/mol, XLogP of 2.35, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1R,2S)-2-fluoro-N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclopentyl]cyclohexane-1-sulfonamide is sourced from PubChem (CID 154810650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).