1-amino-N-[4-(methanesulfonamidomethyl)phenyl]cyclohexane-1-carboxamide;hydrochloride

C15H24ClN3O3S — CID 119328489

IUPAC1-amino-N-[4-(methanesulfonamidomethyl)phenyl]cyclohexane-1-carboxamide;hydrochloride
SMILESCS(=O)(=O)NCc1ccc(NC(=O)C2(N)CCCCC2)cc1.Cl
InChIInChI=1S/C15H23N3O3S.ClH/c1-22(20,21)17-11-12-5-7-13(8-6-12)18-14(19)15(16)9-3-2-4-10-15;/h5-8,17H,2-4,9-11,16H2,1H3,(H,18,19);1H
InChIKeyZEHLFMCSAXTOAH-UHFFFAOYSA-N
MW361.90 g/mol
LogP1.76
Rot. Bonds5

About 1-amino-N-[4-(methanesulfonamidomethyl)phenyl]cyclohexane-1-carboxamide;hydrochloride

1-amino-N-[4-(methanesulfonamidomethyl)phenyl]cyclohexane-1-carboxamide;hydrochloride (PubChem CID 119328489) has the molecular formula C15H24ClN3O3S and a molecular weight of 361.90 g/mol. Its IUPAC name is 1-amino-N-[4-(methanesulfonamidomethyl)phenyl]cyclohexane-1-carboxamide;hydrochloride.

Molecular Properties

Compound Name1-amino-N-[4-(methanesulfonamidomethyl)phenyl]cyclohexane-1-carboxamide;hydrochloride
PubChem CID119328489
Molecular FormulaC15H24ClN3O3S
Molecular Weight361.90 g/mol
Exact Mass361.12
IUPAC Name1-amino-N-[4-(methanesulfonamidomethyl)phenyl]cyclohexane-1-carboxamide;hydrochloride
SMILESCS(=O)(=O)NCc1ccc(NC(=O)C2(N)CCCCC2)cc1.Cl
InChIInChI=1S/C15H23N3O3S.ClH/c1-22(20,21)17-11-12-5-7-13(8-6-12)18-14(19)15(16)9-3-2-4-10-15;/h5-8,17H,2-4,9-11,16H2,1H3,(H,18,19);1H
InChIKeyZEHLFMCSAXTOAH-UHFFFAOYSA-N
XLogP1.76
TPSA101.29 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.90
LogP ≤ 51.76
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 1-amino-N-[4-(methanesulfonamidomethyl)phenyl]cyclohexane-1-carboxamide;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(4-acetamidophenyl)methyl]-1-aminocyclohexane-1-carboxamide;hydrochloride
CID 119277261
1-amino-N-(4-ethylphenyl)cyclopentane-1-carboxamide
CID 60867224
1-amino-N-[4-(hydroxymethyl)phenyl]cyclohexane-1-carboxamide
CID 113397756
1-amino-N-[4-(cyclopropylmethylsulfamoyl)phenyl]cyclohexane-1-carboxamide;hydrochloride
CID 119287766
1-amino-N-[4-(2-methylsulfanylethyl)phenyl]cyclohexane-1-carboxamide;hydrochloride
CID 119315486
1-amino-N-(4-propylphenyl)cyclopentane-1-carboxamide
CID 54925144
1-amino-N-(4-fluorophenyl)cyclohexane-1-carboxamide;hydrochloride
CID 119261942
1-amino-N-(4-propan-2-yloxyphenyl)cyclohexane-1-carboxamide;hydrochloride
CID 119280469
1-amino-N-(4-propan-2-ylphenyl)cyclohexane-1-carboxamide;hydrochloride
CID 119262760
1-amino-N-[4-(propan-2-ylcarbamoylamino)phenyl]cyclohexane-1-carboxamide;hydrochloride
CID 119279259
1-amino-N-[4-(butylsulfonylamino)phenyl]cyclohexane-1-carboxamide
CID 119333210
1-amino-N-[4-(dimethylsulfamoyl)phenyl]cyclopentane-1-carboxamide
CID 60866670

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-[4-(methanesulfonamidomethyl)phenyl]cyclohexane-1-carboxamide;hydrochloride?
The IUPAC name of 1-amino-N-[4-(methanesulfonamidomethyl)phenyl]cyclohexane-1-carboxamide;hydrochloride (CID 119328489) is 1-amino-N-[4-(methanesulfonamidomethyl)phenyl]cyclohexane-1-carboxamide;hydrochloride.
What is the SMILES notation for 1-amino-N-[4-(methanesulfonamidomethyl)phenyl]cyclohexane-1-carboxamide;hydrochloride?
The canonical SMILES for 1-amino-N-[4-(methanesulfonamidomethyl)phenyl]cyclohexane-1-carboxamide;hydrochloride is CS(=O)(=O)NCc1ccc(NC(=O)C2(N)CCCCC2)cc1.Cl.
What is the InChIKey of 1-amino-N-[4-(methanesulfonamidomethyl)phenyl]cyclohexane-1-carboxamide;hydrochloride?
The InChIKey is ZEHLFMCSAXTOAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O3S.ClH/c1-22(20,21)17-11-12-5-7-13(8-6-12)18-14(19)15(16)9-3-2-4-10-15;/h5-8,17H,2-4,9-11,16H2,1H3,(H,18,19);1H.
What are the key properties of 1-amino-N-[4-(methanesulfonamidomethyl)phenyl]cyclohexane-1-carboxamide;hydrochloride?
1-amino-N-[4-(methanesulfonamidomethyl)phenyl]cyclohexane-1-carboxamide;hydrochloride has a molecular weight of 361.90 g/mol, XLogP of 1.76, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-[4-(methanesulfonamidomethyl)phenyl]cyclohexane-1-carboxamide;hydrochloride is sourced from PubChem (CID 119328489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).