N-(1-amino-2-methylpropan-2-yl)-3-(cyclopropylsulfamoyl)benzamide;hydrochloride

C14H22ClN3O3S — CID 119521902

IUPACN-(1-amino-2-methylpropan-2-yl)-3-(cyclopropylsulfamoyl)benzamide;hydrochloride
SMILESCC(C)(CN)NC(=O)c1cccc(S(=O)(=O)NC2CC2)c1.Cl
InChIInChI=1S/C14H21N3O3S.ClH/c1-14(2,9-15)16-13(18)10-4-3-5-12(8-10)21(19,20)17-11-6-7-11;/h3-5,8,11,17H,6-7,9,15H2,1-2H3,(H,16,18);1H
InChIKeyZWADIKWHNGIPCJ-UHFFFAOYSA-N
MW347.87 g/mol
LogP1.02
Rot. Bonds6

About N-(1-amino-2-methylpropan-2-yl)-3-(cyclopropylsulfamoyl)benzamide;hydrochloride

N-(1-amino-2-methylpropan-2-yl)-3-(cyclopropylsulfamoyl)benzamide;hydrochloride (PubChem CID 119521902) has the molecular formula C14H22ClN3O3S and a molecular weight of 347.87 g/mol. Its IUPAC name is N-(1-amino-2-methylpropan-2-yl)-3-(cyclopropylsulfamoyl)benzamide;hydrochloride.

Molecular Properties

Compound NameN-(1-amino-2-methylpropan-2-yl)-3-(cyclopropylsulfamoyl)benzamide;hydrochloride
PubChem CID119521902
Molecular FormulaC14H22ClN3O3S
Molecular Weight347.87 g/mol
Exact Mass347.11
IUPAC NameN-(1-amino-2-methylpropan-2-yl)-3-(cyclopropylsulfamoyl)benzamide;hydrochloride
SMILESCC(C)(CN)NC(=O)c1cccc(S(=O)(=O)NC2CC2)c1.Cl
InChIInChI=1S/C14H21N3O3S.ClH/c1-14(2,9-15)16-13(18)10-4-3-5-12(8-10)21(19,20)17-11-6-7-11;/h3-5,8,11,17H,6-7,9,15H2,1-2H3,(H,16,18);1H
InChIKeyZWADIKWHNGIPCJ-UHFFFAOYSA-N
XLogP1.02
TPSA101.29 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.87
LogP ≤ 51.02
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1-amino-2-methylpropan-2-yl)-3-(cyclopentylsulfamoyl)benzamide;hydrochloride
CID 119521472
N-(1-amino-2,3-dimethylbutan-2-yl)-3-(cyclopropylsulfamoyl)benzamide;hydrochloride
CID 119605990
3-(cyclopropylsulfamoyl)-N-[2-(methylamino)ethyl]benzamide;hydrochloride
CID 119500565
N-(3-aminopropyl)-3-(cyclopropylsulfamoyl)benzamide
CID 119405427
N-(3-aminobutyl)-3-(cyclopropylsulfamoyl)benzamide;hydrochloride
CID 119495504
3-(cyclohexylsulfamoyl)-N-cyclopentylbenzamide
CID 109063195
3-[[4-(2-methylbutan-2-yl)cyclohexyl]sulfamoyl]benzamide
CID 112845274
3-(cyclopentylsulfamoyl)-N-ethylbenzamide
CID 30830540
3-amino-N-[3-(cyclopropylsulfamoyl)phenyl]-2,2-dimethylpropanamide
CID 81486538
N-(1-amino-2-methylpropan-2-yl)-3-methylbenzamide;hydrochloride
CID 119523789
3-N-(1-amino-2-methylpropan-2-yl)benzene-1,3-dicarboxamide;hydrochloride
CID 119523948
3-[[3-(cyclopentylsulfamoyl)benzoyl]amino]-2,2-dimethylpropanoic acid
CID 119249979

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-2-methylpropan-2-yl)-3-(cyclopropylsulfamoyl)benzamide;hydrochloride?
The IUPAC name of N-(1-amino-2-methylpropan-2-yl)-3-(cyclopropylsulfamoyl)benzamide;hydrochloride (CID 119521902) is N-(1-amino-2-methylpropan-2-yl)-3-(cyclopropylsulfamoyl)benzamide;hydrochloride.
What is the SMILES notation for N-(1-amino-2-methylpropan-2-yl)-3-(cyclopropylsulfamoyl)benzamide;hydrochloride?
The canonical SMILES for N-(1-amino-2-methylpropan-2-yl)-3-(cyclopropylsulfamoyl)benzamide;hydrochloride is CC(C)(CN)NC(=O)c1cccc(S(=O)(=O)NC2CC2)c1.Cl.
What is the InChIKey of N-(1-amino-2-methylpropan-2-yl)-3-(cyclopropylsulfamoyl)benzamide;hydrochloride?
The InChIKey is ZWADIKWHNGIPCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O3S.ClH/c1-14(2,9-15)16-13(18)10-4-3-5-12(8-10)21(19,20)17-11-6-7-11;/h3-5,8,11,17H,6-7,9,15H2,1-2H3,(H,16,18);1H.
What are the key properties of N-(1-amino-2-methylpropan-2-yl)-3-(cyclopropylsulfamoyl)benzamide;hydrochloride?
N-(1-amino-2-methylpropan-2-yl)-3-(cyclopropylsulfamoyl)benzamide;hydrochloride has a molecular weight of 347.87 g/mol, XLogP of 1.02, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-2-methylpropan-2-yl)-3-(cyclopropylsulfamoyl)benzamide;hydrochloride is sourced from PubChem (CID 119521902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).