cis-(1R,2S)-2-cyclopropyl-N-[3-(1,3,4-oxadiazol-2-yl)phenyl]sulfonylcyclopropane-1-carboxamide

C15H15N3O4S — CID 99708540

IUPACcis-(1R,2S)-2-cyclopropyl-N-[3-(1,3,4-oxadiazol-2-yl)phenyl]sulfonylcyclopropane-1-carboxamide
SMILESO=C(NS(=O)(=O)c1cccc(-c2nnco2)c1)[C@@H]1C[C@H]1C1CC1
InChIInChI=1S/C15H15N3O4S/c19-14(13-7-12(13)9-4-5-9)18-23(20,21)11-3-1-2-10(6-11)15-17-16-8-22-15/h1-3,6,8-9,12-13H,4-5,7H2,(H,18,19)/t12-,13+/m0/s1
InChIKeyRALHNSXOLGSYBT-QWHCGFSZSA-N
MW333.37 g/mol
LogP1.59
Rot. Bonds5

About cis-(1R,2S)-2-cyclopropyl-N-[3-(1,3,4-oxadiazol-2-yl)phenyl]sulfonylcyclopropane-1-carboxamide

cis-(1R,2S)-2-cyclopropyl-N-[3-(1,3,4-oxadiazol-2-yl)phenyl]sulfonylcyclopropane-1-carboxamide (PubChem CID 99708540) has the molecular formula C15H15N3O4S and a molecular weight of 333.37 g/mol. Its IUPAC name is cis-(1R,2S)-2-cyclopropyl-N-[3-(1,3,4-oxadiazol-2-yl)phenyl]sulfonylcyclopropane-1-carboxamide.

Molecular Properties

Compound Namecis-(1R,2S)-2-cyclopropyl-N-[3-(1,3,4-oxadiazol-2-yl)phenyl]sulfonylcyclopropane-1-carboxamide
PubChem CID99708540
Molecular FormulaC15H15N3O4S
Molecular Weight333.37 g/mol
Exact Mass333.08
IUPAC Namecis-(1R,2S)-2-cyclopropyl-N-[3-(1,3,4-oxadiazol-2-yl)phenyl]sulfonylcyclopropane-1-carboxamide
SMILESO=C(NS(=O)(=O)c1cccc(-c2nnco2)c1)[C@@H]1C[C@H]1C1CC1
InChIInChI=1S/C15H15N3O4S/c19-14(13-7-12(13)9-4-5-9)18-23(20,21)11-3-1-2-10(6-11)15-17-16-8-22-15/h1-3,6,8-9,12-13H,4-5,7H2,(H,18,19)/t12-,13+/m0/s1
InChIKeyRALHNSXOLGSYBT-QWHCGFSZSA-N
XLogP1.59
TPSA102.16 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.37
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze cis-(1R,2S)-2-cyclopropyl-N-[3-(1,3,4-oxadiazol-2-yl)phenyl]sulfonylcyclopropane-1-carboxamide 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

trans-(1S,2S)-2-cyclohexyl-N-[3-(1,3,4-oxadiazol-2-yl)phenyl]sulfonylcyclopropane-1-carboxamide
CID 99708524
(E)-3-cyclopropyl-N-[3-(1,3,4-oxadiazol-2-yl)phenyl]sulfonylbut-2-enamide
CID 132969952
(2R)-N-[3-(1,3,4-oxadiazol-2-yl)phenyl]sulfonyl-2-phenylbutanamide
CID 97025860
2-[3-[[(2R,3aR,7aR)-2-methyl-2,3,3a,4,5,6,7,7a-octahydroindol-1-yl]sulfonyl]phenyl]-1,3,4-oxadiazole
CID 124726979
2-(3-pyrrolidin-1-ylsulfonylphenyl)-1,3,4-oxadiazole
CID 2408760
cis-(1R,2S)-2-cyclopropyl-N-(4-cyclopropylphenyl)sulfonylcyclopropane-1-carboxamide
CID 146146413
1-[4-[3-(1,3,4-oxadiazol-2-yl)anilino]piperidin-1-yl]ethanone
CID 43770533
N-(3-methylsulfonylphenyl)sulfonylbicyclo[2.2.1]heptane-2-carboxamide
CID 71890926
cis-(1R,2S)-2-cyclobutyl-N-(1,3-dimethyl-2-oxobenzimidazol-5-yl)sulfonylcyclopropane-1-carboxamide
CID 136583205
[(3R,4R)-1-[3-(1,3,4-oxadiazol-2-yl)phenyl]sulfonyl-4-phenylpiperidin-3-yl]methanol
CID 126798770
2-(3-methylphenyl)-1,3,4-oxadiazole
CID 22937238
1-cycloheptyl-3-[3-(1,3,4-oxadiazol-2-yl)phenyl]urea
CID 47033580

Frequently Asked Questions

What is the IUPAC name of cis-(1R,2S)-2-cyclopropyl-N-[3-(1,3,4-oxadiazol-2-yl)phenyl]sulfonylcyclopropane-1-carboxamide?
The IUPAC name of cis-(1R,2S)-2-cyclopropyl-N-[3-(1,3,4-oxadiazol-2-yl)phenyl]sulfonylcyclopropane-1-carboxamide (CID 99708540) is cis-(1R,2S)-2-cyclopropyl-N-[3-(1,3,4-oxadiazol-2-yl)phenyl]sulfonylcyclopropane-1-carboxamide.
What is the SMILES notation for cis-(1R,2S)-2-cyclopropyl-N-[3-(1,3,4-oxadiazol-2-yl)phenyl]sulfonylcyclopropane-1-carboxamide?
The canonical SMILES for cis-(1R,2S)-2-cyclopropyl-N-[3-(1,3,4-oxadiazol-2-yl)phenyl]sulfonylcyclopropane-1-carboxamide is O=C(NS(=O)(=O)c1cccc(-c2nnco2)c1)[C@@H]1C[C@H]1C1CC1.
What is the InChIKey of cis-(1R,2S)-2-cyclopropyl-N-[3-(1,3,4-oxadiazol-2-yl)phenyl]sulfonylcyclopropane-1-carboxamide?
The InChIKey is RALHNSXOLGSYBT-QWHCGFSZSA-N. The full InChI is InChI=1S/C15H15N3O4S/c19-14(13-7-12(13)9-4-5-9)18-23(20,21)11-3-1-2-10(6-11)15-17-16-8-22-15/h1-3,6,8-9,12-13H,4-5,7H2,(H,18,19)/t12-,13+/m0/s1.
What are the key properties of cis-(1R,2S)-2-cyclopropyl-N-[3-(1,3,4-oxadiazol-2-yl)phenyl]sulfonylcyclopropane-1-carboxamide?
cis-(1R,2S)-2-cyclopropyl-N-[3-(1,3,4-oxadiazol-2-yl)phenyl]sulfonylcyclopropane-1-carboxamide has a molecular weight of 333.37 g/mol, XLogP of 1.59, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1R,2S)-2-cyclopropyl-N-[3-(1,3,4-oxadiazol-2-yl)phenyl]sulfonylcyclopropane-1-carboxamide is sourced from PubChem (CID 99708540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).