N-[(1-methylcyclohexyl)methyl]-4-sulfamoylbenzamide

C15H22N2O3S — CID 103754265

IUPACN-[(1-methylcyclohexyl)methyl]-4-sulfamoylbenzamide
SMILESCC1(CNC(=O)c2ccc(S(N)(=O)=O)cc2)CCCCC1
InChIInChI=1S/C15H22N2O3S/c1-15(9-3-2-4-10-15)11-17-14(18)12-5-7-13(8-6-12)21(16,19)20/h5-8H,2-4,9-11H2,1H3,(H,17,18)(H2,16,19,20)
InChIKeyOOIDDKBLYZMZCF-UHFFFAOYSA-N
MW310.42 g/mol
LogP2.03
Rot. Bonds4

About N-[(1-methylcyclohexyl)methyl]-4-sulfamoylbenzamide

N-[(1-methylcyclohexyl)methyl]-4-sulfamoylbenzamide (PubChem CID 103754265) has the molecular formula C15H22N2O3S and a molecular weight of 310.42 g/mol. Its IUPAC name is N-[(1-methylcyclohexyl)methyl]-4-sulfamoylbenzamide.

Molecular Properties

Compound NameN-[(1-methylcyclohexyl)methyl]-4-sulfamoylbenzamide
PubChem CID103754265
Molecular FormulaC15H22N2O3S
Molecular Weight310.42 g/mol
Exact Mass310.14
IUPAC NameN-[(1-methylcyclohexyl)methyl]-4-sulfamoylbenzamide
SMILESCC1(CNC(=O)c2ccc(S(N)(=O)=O)cc2)CCCCC1
InChIInChI=1S/C15H22N2O3S/c1-15(9-3-2-4-10-15)11-17-14(18)12-5-7-13(8-6-12)21(16,19)20/h5-8H,2-4,9-11H2,1H3,(H,17,18)(H2,16,19,20)
InChIKeyOOIDDKBLYZMZCF-UHFFFAOYSA-N
XLogP2.03
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.42
LogP ≤ 52.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1-methylcyclopentyl)methyl]-4-sulfamoylbenzamide
CID 63821642
4-bromo-N-[(1-methylcyclobutyl)methyl]-3-sulfamoylbenzamide
CID 113252067
N-[(1-methylcyclopentyl)methyl]-5-sulfamoylthiophene-3-carboxamide
CID 63823232
4-(ethylamino)-N-[(1-methylcyclopentyl)methyl]benzamide
CID 63830909
N-ethyl-4-sulfamoylbenzamide
CID 10242881
3-bromo-4-chloro-N-[(1-methylcyclohexyl)methyl]benzamide
CID 114094949
3-hydroxy-N-[(1-methylcyclohexyl)methyl]-4-nitrobenzamide
CID 103756097
4-sulfamoyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]benzamide
CID 79359507
3-amino-N-[(1-methylcyclohexyl)methyl]benzamide
CID 103813013
3-bromo-4-methyl-N-[(1-methylcyclopentyl)methyl]benzamide
CID 81472478
2-fluoro-N-[(1-methylcyclopropyl)methyl]-4-sulfamoylbenzamide
CID 113346358
3,5-dihydroxy-N-[(1-methylcyclohexyl)methyl]benzamide
CID 104939154

Frequently Asked Questions

What is the IUPAC name of N-[(1-methylcyclohexyl)methyl]-4-sulfamoylbenzamide?
The IUPAC name of N-[(1-methylcyclohexyl)methyl]-4-sulfamoylbenzamide (CID 103754265) is N-[(1-methylcyclohexyl)methyl]-4-sulfamoylbenzamide.
What is the SMILES notation for N-[(1-methylcyclohexyl)methyl]-4-sulfamoylbenzamide?
The canonical SMILES for N-[(1-methylcyclohexyl)methyl]-4-sulfamoylbenzamide is CC1(CNC(=O)c2ccc(S(N)(=O)=O)cc2)CCCCC1.
What is the InChIKey of N-[(1-methylcyclohexyl)methyl]-4-sulfamoylbenzamide?
The InChIKey is OOIDDKBLYZMZCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O3S/c1-15(9-3-2-4-10-15)11-17-14(18)12-5-7-13(8-6-12)21(16,19)20/h5-8H,2-4,9-11H2,1H3,(H,17,18)(H2,16,19,20).
What are the key properties of N-[(1-methylcyclohexyl)methyl]-4-sulfamoylbenzamide?
N-[(1-methylcyclohexyl)methyl]-4-sulfamoylbenzamide has a molecular weight of 310.42 g/mol, XLogP of 2.03, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-methylcyclohexyl)methyl]-4-sulfamoylbenzamide is sourced from PubChem (CID 103754265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).