N-cyclohexyl-4-(methanesulfonamidomethyl)benzamide

C15H22N2O3S — CID 715136

IUPACN-cyclohexyl-4-(methanesulfonamidomethyl)benzamide
SMILESCS(=O)(=O)NCc1ccc(C(=O)NC2CCCCC2)cc1
InChIInChI=1S/C15H22N2O3S/c1-21(19,20)16-11-12-7-9-13(10-8-12)15(18)17-14-5-3-2-4-6-14/h7-10,14,16H,2-6,11H2,1H3,(H,17,18)
InChIKeyPBATXOJBTZLBHE-UHFFFAOYSA-N
MW310.42 g/mol
LogP1.80
Rot. Bonds5

About N-cyclohexyl-4-(methanesulfonamidomethyl)benzamide

N-cyclohexyl-4-(methanesulfonamidomethyl)benzamide (PubChem CID 715136) has the molecular formula C15H22N2O3S and a molecular weight of 310.42 g/mol. Its IUPAC name is N-cyclohexyl-4-(methanesulfonamidomethyl)benzamide.

Molecular Properties

Compound NameN-cyclohexyl-4-(methanesulfonamidomethyl)benzamide
PubChem CID715136
Molecular FormulaC15H22N2O3S
Molecular Weight310.42 g/mol
Exact Mass310.14
IUPAC NameN-cyclohexyl-4-(methanesulfonamidomethyl)benzamide
SMILESCS(=O)(=O)NCc1ccc(C(=O)NC2CCCCC2)cc1
InChIInChI=1S/C15H22N2O3S/c1-21(19,20)16-11-12-7-9-13(10-8-12)15(18)17-14-5-3-2-4-6-14/h7-10,14,16H,2-6,11H2,1H3,(H,17,18)
InChIKeyPBATXOJBTZLBHE-UHFFFAOYSA-N
XLogP1.80
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.42
LogP ≤ 51.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-4-(methanesulfonamidomethyl)benzamide?
The IUPAC name of N-cyclohexyl-4-(methanesulfonamidomethyl)benzamide (CID 715136) is N-cyclohexyl-4-(methanesulfonamidomethyl)benzamide.
What is the SMILES notation for N-cyclohexyl-4-(methanesulfonamidomethyl)benzamide?
The canonical SMILES for N-cyclohexyl-4-(methanesulfonamidomethyl)benzamide is CS(=O)(=O)NCc1ccc(C(=O)NC2CCCCC2)cc1.
What is the InChIKey of N-cyclohexyl-4-(methanesulfonamidomethyl)benzamide?
The InChIKey is PBATXOJBTZLBHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O3S/c1-21(19,20)16-11-12-7-9-13(10-8-12)15(18)17-14-5-3-2-4-6-14/h7-10,14,16H,2-6,11H2,1H3,(H,17,18).
What are the key properties of N-cyclohexyl-4-(methanesulfonamidomethyl)benzamide?
N-cyclohexyl-4-(methanesulfonamidomethyl)benzamide has a molecular weight of 310.42 g/mol, XLogP of 1.80, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-4-(methanesulfonamidomethyl)benzamide is sourced from PubChem (CID 715136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).