N-[4-(methanesulfonamido)phenyl]-N-methylcyclohexanecarboxamide

C15H22N2O3S — CID 113094578

IUPACN-[4-(methanesulfonamido)phenyl]-N-methylcyclohexanecarboxamide
SMILESCN(C(=O)C1CCCCC1)c1ccc(NS(C)(=O)=O)cc1
InChIInChI=1S/C15H22N2O3S/c1-17(15(18)12-6-4-3-5-7-12)14-10-8-13(9-11-14)16-21(2,19)20/h8-12,16H,3-7H2,1-2H3
InChIKeyNWMAEAZUMYGFLA-UHFFFAOYSA-N
MW310.42 g/mol
LogP2.60
Rot. Bonds4

About N-[4-(methanesulfonamido)phenyl]-N-methylcyclohexanecarboxamide

N-[4-(methanesulfonamido)phenyl]-N-methylcyclohexanecarboxamide (PubChem CID 113094578) has the molecular formula C15H22N2O3S and a molecular weight of 310.42 g/mol. Its IUPAC name is N-[4-(methanesulfonamido)phenyl]-N-methylcyclohexanecarboxamide.

Molecular Properties

Compound NameN-[4-(methanesulfonamido)phenyl]-N-methylcyclohexanecarboxamide
PubChem CID113094578
Molecular FormulaC15H22N2O3S
Molecular Weight310.42 g/mol
Exact Mass310.14
IUPAC NameN-[4-(methanesulfonamido)phenyl]-N-methylcyclohexanecarboxamide
SMILESCN(C(=O)C1CCCCC1)c1ccc(NS(C)(=O)=O)cc1
InChIInChI=1S/C15H22N2O3S/c1-17(15(18)12-6-4-3-5-7-12)14-10-8-13(9-11-14)16-21(2,19)20/h8-12,16H,3-7H2,1-2H3
InChIKeyNWMAEAZUMYGFLA-UHFFFAOYSA-N
XLogP2.60
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.42
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-acetamidophenyl)-N-methylcyclohexanecarboxamide
CID 113094937
N-methyl-N-(4-methylphenyl)cyclohexanecarboxamide
CID 142999335
N-[4-[acetyl(methyl)amino]phenyl]-N-methylcyclohexanecarboxamide
CID 113094811
N-(4-acetamidophenyl)-N-methylcyclobutanecarboxamide
CID 113095001
N-methyl-N-(4-methylsulfonylphenyl)cyclopropanecarboxamide
CID 136579118
N-(4-carbamothioylphenyl)-N-methylcycloheptanecarboxamide
CID 62969973
N-(4-carbamothioylphenyl)-N-methylcyclohexanecarboxamide
CID 62971005
N-[4-(cyclobutanecarbonyl)phenyl]methanesulfonamide
CID 43161158
2-[4-[cyclohexanecarbonyl(methyl)amino]phenyl]acetic acid
CID 28759748
4-[(1S)-1-amino-2-[cyclobutyl(methyl)amino]-2-oxoethyl]-N-[3-(methanesulfonamido)phenyl]-N-methylcyclohexane-1-carboxamide
CID 70338488
1-cyclododecyl-3-[4-(methanesulfonamido)phenyl]urea
CID 108875238
N-methyl-N-[6-(methylamino)-3-pyridinyl]cyclohexanecarboxamide
CID 115268525

Frequently Asked Questions

What is the IUPAC name of N-[4-(methanesulfonamido)phenyl]-N-methylcyclohexanecarboxamide?
The IUPAC name of N-[4-(methanesulfonamido)phenyl]-N-methylcyclohexanecarboxamide (CID 113094578) is N-[4-(methanesulfonamido)phenyl]-N-methylcyclohexanecarboxamide.
What is the SMILES notation for N-[4-(methanesulfonamido)phenyl]-N-methylcyclohexanecarboxamide?
The canonical SMILES for N-[4-(methanesulfonamido)phenyl]-N-methylcyclohexanecarboxamide is CN(C(=O)C1CCCCC1)c1ccc(NS(C)(=O)=O)cc1.
What is the InChIKey of N-[4-(methanesulfonamido)phenyl]-N-methylcyclohexanecarboxamide?
The InChIKey is NWMAEAZUMYGFLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O3S/c1-17(15(18)12-6-4-3-5-7-12)14-10-8-13(9-11-14)16-21(2,19)20/h8-12,16H,3-7H2,1-2H3.
What are the key properties of N-[4-(methanesulfonamido)phenyl]-N-methylcyclohexanecarboxamide?
N-[4-(methanesulfonamido)phenyl]-N-methylcyclohexanecarboxamide has a molecular weight of 310.42 g/mol, XLogP of 2.60, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(methanesulfonamido)phenyl]-N-methylcyclohexanecarboxamide is sourced from PubChem (CID 113094578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).