N-[2-(cyclohexanecarbonyl)phenyl]methanesulfonamide

C14H19NO3S — CID 14771346

IUPACN-[2-(cyclohexanecarbonyl)phenyl]methanesulfonamide
SMILESCS(=O)(=O)Nc1ccccc1C(=O)C1CCCCC1
InChIInChI=1S/C14H19NO3S/c1-19(17,18)15-13-10-6-5-9-12(13)14(16)11-7-3-2-4-8-11/h5-6,9-11,15H,2-4,7-8H2,1H3
InChIKeyNNPYWAKQQZMTRV-UHFFFAOYSA-N
MW281.38 g/mol
LogP2.82
Rot. Bonds4

About N-[2-(cyclohexanecarbonyl)phenyl]methanesulfonamide

N-[2-(cyclohexanecarbonyl)phenyl]methanesulfonamide (PubChem CID 14771346) has the molecular formula C14H19NO3S and a molecular weight of 281.38 g/mol. Its IUPAC name is N-[2-(cyclohexanecarbonyl)phenyl]methanesulfonamide.

Molecular Properties

Compound NameN-[2-(cyclohexanecarbonyl)phenyl]methanesulfonamide
PubChem CID14771346
Molecular FormulaC14H19NO3S
Molecular Weight281.38 g/mol
Exact Mass281.11
IUPAC NameN-[2-(cyclohexanecarbonyl)phenyl]methanesulfonamide
SMILESCS(=O)(=O)Nc1ccccc1C(=O)C1CCCCC1
InChIInChI=1S/C14H19NO3S/c1-19(17,18)15-13-10-6-5-9-12(13)14(16)11-7-3-2-4-8-11/h5-6,9-11,15H,2-4,7-8H2,1H3
InChIKeyNNPYWAKQQZMTRV-UHFFFAOYSA-N
XLogP2.82
TPSA63.24 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.38
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-(cyclohexanecarbonyl)phenyl]methanesulfonamide?
The IUPAC name of N-[2-(cyclohexanecarbonyl)phenyl]methanesulfonamide (CID 14771346) is N-[2-(cyclohexanecarbonyl)phenyl]methanesulfonamide.
What is the SMILES notation for N-[2-(cyclohexanecarbonyl)phenyl]methanesulfonamide?
The canonical SMILES for N-[2-(cyclohexanecarbonyl)phenyl]methanesulfonamide is CS(=O)(=O)Nc1ccccc1C(=O)C1CCCCC1.
What is the InChIKey of N-[2-(cyclohexanecarbonyl)phenyl]methanesulfonamide?
The InChIKey is NNPYWAKQQZMTRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO3S/c1-19(17,18)15-13-10-6-5-9-12(13)14(16)11-7-3-2-4-8-11/h5-6,9-11,15H,2-4,7-8H2,1H3.
What are the key properties of N-[2-(cyclohexanecarbonyl)phenyl]methanesulfonamide?
N-[2-(cyclohexanecarbonyl)phenyl]methanesulfonamide has a molecular weight of 281.38 g/mol, XLogP of 2.82, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(cyclohexanecarbonyl)phenyl]methanesulfonamide is sourced from PubChem (CID 14771346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).