1-(benzenesulfonyl)-N-phenylcyclopentane-1-carboxamide

C18H19NO3S — CID 17438426

IUPAC1-(benzenesulfonyl)-N-phenylcyclopentane-1-carboxamide
SMILESO=C(Nc1ccccc1)C1(S(=O)(=O)c2ccccc2)CCCC1
InChIInChI=1S/C18H19NO3S/c20-17(19-15-9-3-1-4-10-15)18(13-7-8-14-18)23(21,22)16-11-5-2-6-12-16/h1-6,9-12H,7-8,13-14H2,(H,19,20)
InChIKeyOZRQRMROTZOSAI-UHFFFAOYSA-N
MW329.42 g/mol
LogP3.41
Rot. Bonds4

About 1-(benzenesulfonyl)-N-phenylcyclopentane-1-carboxamide

1-(benzenesulfonyl)-N-phenylcyclopentane-1-carboxamide (PubChem CID 17438426) has the molecular formula C18H19NO3S and a molecular weight of 329.42 g/mol. Its IUPAC name is 1-(benzenesulfonyl)-N-phenylcyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-(benzenesulfonyl)-N-phenylcyclopentane-1-carboxamide
PubChem CID17438426
Molecular FormulaC18H19NO3S
Molecular Weight329.42 g/mol
Exact Mass329.11
IUPAC Name1-(benzenesulfonyl)-N-phenylcyclopentane-1-carboxamide
SMILESO=C(Nc1ccccc1)C1(S(=O)(=O)c2ccccc2)CCCC1
InChIInChI=1S/C18H19NO3S/c20-17(19-15-9-3-1-4-10-15)18(13-7-8-14-18)23(21,22)16-11-5-2-6-12-16/h1-6,9-12H,7-8,13-14H2,(H,19,20)
InChIKeyOZRQRMROTZOSAI-UHFFFAOYSA-N
XLogP3.41
TPSA63.24 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.42
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-chlorophenyl)sulfonyl-N-[4-(phenylcarbamoylamino)phenyl]cyclopentane-1-carboxamide
CID 31825356
1-(benzenesulfonyl)-N-(4-ethoxyphenyl)cyclopentane-1-carboxamide
CID 17390768
1-(benzenesulfonyl)-N-[3-(diethylsulfamoyl)phenyl]cyclopentane-1-carboxamide
CID 16590699
1-(benzenesulfonyl)-N-(3,4-dimethoxyphenyl)cyclopentane-1-carboxamide
CID 24592826
1-(benzenesulfonyl)-N-(3-methyl-2-pyridinyl)cyclopentane-1-carboxamide
CID 23732618
methyl 5-[[1-(benzenesulfonyl)cyclopentanecarbonyl]amino]-2-fluorobenzoate
CID 30473775
1-(benzenesulfonyl)-N-(4-methyl-1,3-thiazol-2-yl)cyclopentane-1-carboxamide
CID 24592774
1-(benzenesulfonyl)-N-[6-(1,2,4-triazol-1-yl)-3-pyridinyl]cyclopentane-1-carboxamide
CID 30765886
1-(benzenesulfonyl)-N-[(1-hydroxycyclohexyl)methyl]cyclopropane-1-carboxamide
CID 118768125
3-[[1-(benzenesulfonyl)cyclopentanecarbonyl]amino]-4-fluorobenzoic acid
CID 75414478
N-(5-acetamido-2-methoxyphenyl)-1-(benzenesulfonyl)cyclopentane-1-carboxamide
CID 16595027
1-(benzenesulfonyl)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)cyclopentane-1-carboxamide
CID 16592029

Frequently Asked Questions

What is the IUPAC name of 1-(benzenesulfonyl)-N-phenylcyclopentane-1-carboxamide?
The IUPAC name of 1-(benzenesulfonyl)-N-phenylcyclopentane-1-carboxamide (CID 17438426) is 1-(benzenesulfonyl)-N-phenylcyclopentane-1-carboxamide.
What is the SMILES notation for 1-(benzenesulfonyl)-N-phenylcyclopentane-1-carboxamide?
The canonical SMILES for 1-(benzenesulfonyl)-N-phenylcyclopentane-1-carboxamide is O=C(Nc1ccccc1)C1(S(=O)(=O)c2ccccc2)CCCC1.
What is the InChIKey of 1-(benzenesulfonyl)-N-phenylcyclopentane-1-carboxamide?
The InChIKey is OZRQRMROTZOSAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19NO3S/c20-17(19-15-9-3-1-4-10-15)18(13-7-8-14-18)23(21,22)16-11-5-2-6-12-16/h1-6,9-12H,7-8,13-14H2,(H,19,20).
What are the key properties of 1-(benzenesulfonyl)-N-phenylcyclopentane-1-carboxamide?
1-(benzenesulfonyl)-N-phenylcyclopentane-1-carboxamide has a molecular weight of 329.42 g/mol, XLogP of 3.41, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(benzenesulfonyl)-N-phenylcyclopentane-1-carboxamide is sourced from PubChem (CID 17438426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).