1-(benzenesulfonyl)-N-(4-methyl-1,3-thiazol-2-yl)cyclopentane-1-carboxamide

C16H18N2O3S2 — CID 24592774

IUPAC1-(benzenesulfonyl)-N-(4-methyl-1,3-thiazol-2-yl)cyclopentane-1-carboxamide
SMILESCc1csc(NC(=O)C2(S(=O)(=O)c3ccccc3)CCCC2)n1
InChIInChI=1S/C16H18N2O3S2/c1-12-11-22-15(17-12)18-14(19)16(9-5-6-10-16)23(20,21)13-7-3-2-4-8-13/h2-4,7-8,11H,5-6,9-10H2,1H3,(H,17,18,19)
InChIKeyGAJZBOAVAXFFBZ-UHFFFAOYSA-N
MW350.47 g/mol
LogP3.18
Rot. Bonds4

About 1-(benzenesulfonyl)-N-(4-methyl-1,3-thiazol-2-yl)cyclopentane-1-carboxamide

1-(benzenesulfonyl)-N-(4-methyl-1,3-thiazol-2-yl)cyclopentane-1-carboxamide (PubChem CID 24592774) has the molecular formula C16H18N2O3S2 and a molecular weight of 350.47 g/mol. Its IUPAC name is 1-(benzenesulfonyl)-N-(4-methyl-1,3-thiazol-2-yl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-(benzenesulfonyl)-N-(4-methyl-1,3-thiazol-2-yl)cyclopentane-1-carboxamide
PubChem CID24592774
Molecular FormulaC16H18N2O3S2
Molecular Weight350.47 g/mol
Exact Mass350.08
IUPAC Name1-(benzenesulfonyl)-N-(4-methyl-1,3-thiazol-2-yl)cyclopentane-1-carboxamide
SMILESCc1csc(NC(=O)C2(S(=O)(=O)c3ccccc3)CCCC2)n1
InChIInChI=1S/C16H18N2O3S2/c1-12-11-22-15(17-12)18-14(19)16(9-5-6-10-16)23(20,21)13-7-3-2-4-8-13/h2-4,7-8,11H,5-6,9-10H2,1H3,(H,17,18,19)
InChIKeyGAJZBOAVAXFFBZ-UHFFFAOYSA-N
XLogP3.18
TPSA76.13 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.47
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(benzenesulfonyl)-N-phenylcyclopentane-1-carboxamide
CID 17438426
1-(benzenesulfonyl)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)cyclopentane-1-carboxamide
CID 16592029
1-(benzenesulfonyl)-N-(6-ethyl-1,3-benzothiazol-2-yl)cyclopentane-1-carboxamide
CID 24594729
1-(4-chlorophenyl)-N-(4-methyl-1,3-thiazol-2-yl)cyclopentane-1-carboxamide
CID 2521715
1-(benzenesulfonyl)-N-[5-(diethylsulfamoyl)-2-methylphenyl]cyclopentane-1-carboxamide
CID 24593032
3-(benzenesulfonamido)-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 24686775
N-[1-(1-adamantyl)ethyl]-1-(benzenesulfonyl)cyclopentane-1-carboxamide
CID 16591786
1-(benzenesulfonyl)-N-(3,4-dimethoxyphenyl)cyclopentane-1-carboxamide
CID 24592826
3-[[1-(benzenesulfonyl)cyclopentanecarbonyl]amino]-4-fluorobenzoic acid
CID 75414478
1-(4-bromophenyl)-N-(4-methyl-1,3-thiazol-2-yl)cyclopropane-1-carboxamide
CID 36600011
2-amino-1-methyl-N-(4-methyl-1,3-thiazol-2-yl)cyclopentane-1-carboxamide
CID 82763752
2-[1-[2-[(4-methyl-1,3-thiazol-2-yl)amino]-2-oxoethyl]cyclopentyl]acetic acid
CID 61070753

Frequently Asked Questions

What is the IUPAC name of 1-(benzenesulfonyl)-N-(4-methyl-1,3-thiazol-2-yl)cyclopentane-1-carboxamide?
The IUPAC name of 1-(benzenesulfonyl)-N-(4-methyl-1,3-thiazol-2-yl)cyclopentane-1-carboxamide (CID 24592774) is 1-(benzenesulfonyl)-N-(4-methyl-1,3-thiazol-2-yl)cyclopentane-1-carboxamide.
What is the SMILES notation for 1-(benzenesulfonyl)-N-(4-methyl-1,3-thiazol-2-yl)cyclopentane-1-carboxamide?
The canonical SMILES for 1-(benzenesulfonyl)-N-(4-methyl-1,3-thiazol-2-yl)cyclopentane-1-carboxamide is Cc1csc(NC(=O)C2(S(=O)(=O)c3ccccc3)CCCC2)n1.
What is the InChIKey of 1-(benzenesulfonyl)-N-(4-methyl-1,3-thiazol-2-yl)cyclopentane-1-carboxamide?
The InChIKey is GAJZBOAVAXFFBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O3S2/c1-12-11-22-15(17-12)18-14(19)16(9-5-6-10-16)23(20,21)13-7-3-2-4-8-13/h2-4,7-8,11H,5-6,9-10H2,1H3,(H,17,18,19).
What are the key properties of 1-(benzenesulfonyl)-N-(4-methyl-1,3-thiazol-2-yl)cyclopentane-1-carboxamide?
1-(benzenesulfonyl)-N-(4-methyl-1,3-thiazol-2-yl)cyclopentane-1-carboxamide has a molecular weight of 350.47 g/mol, XLogP of 3.18, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(benzenesulfonyl)-N-(4-methyl-1,3-thiazol-2-yl)cyclopentane-1-carboxamide is sourced from PubChem (CID 24592774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).