N-(2-amino-1-cyclohexylethyl)-4-(methylsulfamoyl)benzamide;hydrochloride

C16H26ClN3O3S — CID 119589468

IUPACN-(2-amino-1-cyclohexylethyl)-4-(methylsulfamoyl)benzamide;hydrochloride
SMILESCNS(=O)(=O)c1ccc(C(=O)NC(CN)C2CCCCC2)cc1.Cl
InChIInChI=1S/C16H25N3O3S.ClH/c1-18-23(21,22)14-9-7-13(8-10-14)16(20)19-15(11-17)12-5-3-2-4-6-12;/h7-10,12,15,18H,2-6,11,17H2,1H3,(H,19,20);1H
InChIKeyFMXWCHOGZKAVLE-UHFFFAOYSA-N
MW375.92 g/mol
LogP1.65
Rot. Bonds6

About N-(2-amino-1-cyclohexylethyl)-4-(methylsulfamoyl)benzamide;hydrochloride

N-(2-amino-1-cyclohexylethyl)-4-(methylsulfamoyl)benzamide;hydrochloride (PubChem CID 119589468) has the molecular formula C16H26ClN3O3S and a molecular weight of 375.92 g/mol. Its IUPAC name is N-(2-amino-1-cyclohexylethyl)-4-(methylsulfamoyl)benzamide;hydrochloride.

Molecular Properties

Compound NameN-(2-amino-1-cyclohexylethyl)-4-(methylsulfamoyl)benzamide;hydrochloride
PubChem CID119589468
Molecular FormulaC16H26ClN3O3S
Molecular Weight375.92 g/mol
Exact Mass375.14
IUPAC NameN-(2-amino-1-cyclohexylethyl)-4-(methylsulfamoyl)benzamide;hydrochloride
SMILESCNS(=O)(=O)c1ccc(C(=O)NC(CN)C2CCCCC2)cc1.Cl
InChIInChI=1S/C16H25N3O3S.ClH/c1-18-23(21,22)14-9-7-13(8-10-14)16(20)19-15(11-17)12-5-3-2-4-6-12;/h7-10,12,15,18H,2-6,11,17H2,1H3,(H,19,20);1H
InChIKeyFMXWCHOGZKAVLE-UHFFFAOYSA-N
XLogP1.65
TPSA101.29 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.92
LogP ≤ 51.65
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-amino-1-cyclohexylethyl)-4-(butan-2-ylsulfamoyl)benzamide
CID 119591487
N-(2-amino-1-cyclohexylethyl)-3-[4-(methylsulfamoyl)phenyl]propanamide;hydrochloride
CID 119591484
N-(2-amino-1-cyclohexylethyl)-4-[methyl(propan-2-yl)sulfamoyl]benzamide
CID 119591997
N-(2-amino-1-cyclopropylethyl)-4-methylsulfonylbenzamide;hydrochloride
CID 119617428
N-(2-amino-1-cyclopropylethyl)-4-[(2,3-dimethylphenyl)sulfamoyl]benzamide;hydrochloride
CID 119615381
N-(2-amino-1-cyclopentylethyl)-4-methylsulfanylbenzamide
CID 106737308
4-[(2-amino-1-cyclopentylethyl)sulfamoyl]benzamide
CID 106737961
N-(2-amino-1-cyclopropylethyl)-4-(prop-2-enylsulfamoyl)benzamide
CID 119617561
N-(2-amino-1-cyclohexylethyl)-4-(1,3-dithiolan-2-yl)benzamide;hydrochloride
CID 119590390
N-(2-amino-1-cyclohexylethyl)-4-(cyclopropanecarbonylamino)benzamide;hydrochloride
CID 119591804
4-[(2-amino-1-cyclopentylethyl)sulfamoyl]-N,N-dimethylbenzamide;hydrochloride
CID 120713646
N-(2-amino-1-cyclohexylethyl)-4-(3-methoxypropoxy)benzamide;hydrochloride
CID 119590589

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-1-cyclohexylethyl)-4-(methylsulfamoyl)benzamide;hydrochloride?
The IUPAC name of N-(2-amino-1-cyclohexylethyl)-4-(methylsulfamoyl)benzamide;hydrochloride (CID 119589468) is N-(2-amino-1-cyclohexylethyl)-4-(methylsulfamoyl)benzamide;hydrochloride.
What is the SMILES notation for N-(2-amino-1-cyclohexylethyl)-4-(methylsulfamoyl)benzamide;hydrochloride?
The canonical SMILES for N-(2-amino-1-cyclohexylethyl)-4-(methylsulfamoyl)benzamide;hydrochloride is CNS(=O)(=O)c1ccc(C(=O)NC(CN)C2CCCCC2)cc1.Cl.
What is the InChIKey of N-(2-amino-1-cyclohexylethyl)-4-(methylsulfamoyl)benzamide;hydrochloride?
The InChIKey is FMXWCHOGZKAVLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O3S.ClH/c1-18-23(21,22)14-9-7-13(8-10-14)16(20)19-15(11-17)12-5-3-2-4-6-12;/h7-10,12,15,18H,2-6,11,17H2,1H3,(H,19,20);1H.
What are the key properties of N-(2-amino-1-cyclohexylethyl)-4-(methylsulfamoyl)benzamide;hydrochloride?
N-(2-amino-1-cyclohexylethyl)-4-(methylsulfamoyl)benzamide;hydrochloride has a molecular weight of 375.92 g/mol, XLogP of 1.65, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-1-cyclohexylethyl)-4-(methylsulfamoyl)benzamide;hydrochloride is sourced from PubChem (CID 119589468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).