5-chloro-N-[(1R,2S)-2-(cyclopentylamino)cyclobutyl]thiophene-2-sulfonamide

C13H19ClN2O2S2 — CID 133130662

IUPAC5-chloro-N-[(1R,2S)-2-(cyclopentylamino)cyclobutyl]thiophene-2-sulfonamide
SMILESO=S(=O)(N[C@@H]1CC[C@@H]1NC1CCCC1)c1ccc(Cl)s1
InChIInChI=1S/C13H19ClN2O2S2/c14-12-7-8-13(19-12)20(17,18)16-11-6-5-10(11)15-9-3-1-2-4-9/h7-11,15-16H,1-6H2/t10-,11+/m0/s1
InChIKeyVGYWDSADNNQELB-WDEREUQCSA-N
MW334.89 g/mol
LogP2.74
Rot. Bonds5

About 5-chloro-N-[(1R,2S)-2-(cyclopentylamino)cyclobutyl]thiophene-2-sulfonamide

5-chloro-N-[(1R,2S)-2-(cyclopentylamino)cyclobutyl]thiophene-2-sulfonamide (PubChem CID 133130662) has the molecular formula C13H19ClN2O2S2 and a molecular weight of 334.89 g/mol. Its IUPAC name is 5-chloro-N-[(1R,2S)-2-(cyclopentylamino)cyclobutyl]thiophene-2-sulfonamide.

Molecular Properties

Compound Name5-chloro-N-[(1R,2S)-2-(cyclopentylamino)cyclobutyl]thiophene-2-sulfonamide
PubChem CID133130662
Molecular FormulaC13H19ClN2O2S2
Molecular Weight334.89 g/mol
Exact Mass334.06
IUPAC Name5-chloro-N-[(1R,2S)-2-(cyclopentylamino)cyclobutyl]thiophene-2-sulfonamide
SMILESO=S(=O)(N[C@@H]1CC[C@@H]1NC1CCCC1)c1ccc(Cl)s1
InChIInChI=1S/C13H19ClN2O2S2/c14-12-7-8-13(19-12)20(17,18)16-11-6-5-10(11)15-9-3-1-2-4-9/h7-11,15-16H,1-6H2/t10-,11+/m0/s1
InChIKeyVGYWDSADNNQELB-WDEREUQCSA-N
XLogP2.74
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.89
LogP ≤ 52.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-bromocyclopentyl)-5-chlorothiophene-2-sulfonamide
CID 80662650
5-chloro-N-[(1S,3R)-3-hydroxycyclohexyl]thiophene-2-sulfonamide
CID 95984008
5-chloro-N-piperidin-4-ylthiophene-2-sulfonamide
CID 28811036
5-chloro-N-pyrrolidin-3-ylthiophene-2-sulfonamide
CID 62380456
5-chloro-N-[2-(cyclopentylsulfamoyl)ethyl]thiophene-2-sulfonamide
CID 110345807
N-(3-aminocyclobutyl)-5-chlorothiophene-2-sulfonamide
CID 43597846
5-bromo-N-cyclopentylthiophene-2-sulfonamide
CID 893383
5-chloro-N-(2-oxoazepan-3-yl)thiophene-2-sulfonamide
CID 25042934
5-bromo-N-cyclooctylthiophene-2-sulfonamide
CID 19681116
5-chloro-N-(cyclohexylmethyl)thiophene-2-sulfonamide
CID 6470902
5-chloro-N-(3,3-dimethylcyclopentyl)thiophene-2-sulfonamide
CID 115881167
N-[(2-bromocyclohexyl)methyl]-5-chlorothiophene-2-sulfonamide
CID 113271784

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-[(1R,2S)-2-(cyclopentylamino)cyclobutyl]thiophene-2-sulfonamide?
The IUPAC name of 5-chloro-N-[(1R,2S)-2-(cyclopentylamino)cyclobutyl]thiophene-2-sulfonamide (CID 133130662) is 5-chloro-N-[(1R,2S)-2-(cyclopentylamino)cyclobutyl]thiophene-2-sulfonamide.
What is the SMILES notation for 5-chloro-N-[(1R,2S)-2-(cyclopentylamino)cyclobutyl]thiophene-2-sulfonamide?
The canonical SMILES for 5-chloro-N-[(1R,2S)-2-(cyclopentylamino)cyclobutyl]thiophene-2-sulfonamide is O=S(=O)(N[C@@H]1CC[C@@H]1NC1CCCC1)c1ccc(Cl)s1.
What is the InChIKey of 5-chloro-N-[(1R,2S)-2-(cyclopentylamino)cyclobutyl]thiophene-2-sulfonamide?
The InChIKey is VGYWDSADNNQELB-WDEREUQCSA-N. The full InChI is InChI=1S/C13H19ClN2O2S2/c14-12-7-8-13(19-12)20(17,18)16-11-6-5-10(11)15-9-3-1-2-4-9/h7-11,15-16H,1-6H2/t10-,11+/m0/s1.
What are the key properties of 5-chloro-N-[(1R,2S)-2-(cyclopentylamino)cyclobutyl]thiophene-2-sulfonamide?
5-chloro-N-[(1R,2S)-2-(cyclopentylamino)cyclobutyl]thiophene-2-sulfonamide has a molecular weight of 334.89 g/mol, XLogP of 2.74, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-[(1R,2S)-2-(cyclopentylamino)cyclobutyl]thiophene-2-sulfonamide is sourced from PubChem (CID 133130662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).