N-(2-amino-2-methylpropyl)-4-(cyclopropylsulfamoyl)benzamide

C14H21N3O3S — CID 119628503

IUPACN-(2-amino-2-methylpropyl)-4-(cyclopropylsulfamoyl)benzamide
SMILESCC(C)(N)CNC(=O)c1ccc(S(=O)(=O)NC2CC2)cc1
InChIInChI=1S/C14H21N3O3S/c1-14(2,15)9-16-13(18)10-3-7-12(8-4-10)21(19,20)17-11-5-6-11/h3-4,7-8,11,17H,5-6,9,15H2,1-2H3,(H,16,18)
InChIKeyXDLKLNXZCOODOS-UHFFFAOYSA-N
MW311.41 g/mol
LogP0.59
Rot. Bonds6

About N-(2-amino-2-methylpropyl)-4-(cyclopropylsulfamoyl)benzamide

N-(2-amino-2-methylpropyl)-4-(cyclopropylsulfamoyl)benzamide (PubChem CID 119628503) has the molecular formula C14H21N3O3S and a molecular weight of 311.41 g/mol. Its IUPAC name is N-(2-amino-2-methylpropyl)-4-(cyclopropylsulfamoyl)benzamide.

Molecular Properties

Compound NameN-(2-amino-2-methylpropyl)-4-(cyclopropylsulfamoyl)benzamide
PubChem CID119628503
Molecular FormulaC14H21N3O3S
Molecular Weight311.41 g/mol
Exact Mass311.13
IUPAC NameN-(2-amino-2-methylpropyl)-4-(cyclopropylsulfamoyl)benzamide
SMILESCC(C)(N)CNC(=O)c1ccc(S(=O)(=O)NC2CC2)cc1
InChIInChI=1S/C14H21N3O3S/c1-14(2,15)9-16-13(18)10-3-7-12(8-4-10)21(19,20)17-11-5-6-11/h3-4,7-8,11,17H,5-6,9,15H2,1-2H3,(H,16,18)
InChIKeyXDLKLNXZCOODOS-UHFFFAOYSA-N
XLogP0.59
TPSA101.29 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.41
LogP ≤ 50.59
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

4-[(1-methylpiperidin-4-yl)sulfamoyl]-N-(2,2,2-trifluoroethyl)benzamide
CID 78808928
N-[2-[[4-(cyclopropylsulfamoyl)benzoyl]amino]ethyl]-4-(trifluoromethyl)benzamide
CID 34508335
N-(1-amino-2,3-dimethylbutan-2-yl)-4-(cyclopropylsulfamoyl)benzamide
CID 119607469
N-(2-amino-2-methylpropyl)-4-ethylsulfonylbenzamide;hydrochloride
CID 119629953
2-[[4-(cyclopropylsulfamoyl)benzoyl]amino]-2-methylbutanoic acid
CID 119199013
4-(cyclopropylsulfamoyl)-N-[2-(diethylamino)propyl]benzamide
CID 46433043
N-[3-(aminomethyl)pentan-3-yl]-4-(cyclopropylsulfamoyl)benzamide
CID 119570566
4-[(4-aminocyclohexyl)sulfamoyl]-N-methylbenzamide;hydrochloride
CID 119970613
N-(2-amino-2-methylpropyl)-4-(2-methoxyethylsulfamoyl)benzamide;hydrochloride
CID 119627863
4-(cyclopropylsulfamoyl)-N-[(4-fluorophenyl)methyl]benzamide
CID 17496581
4-(cyclopropylsulfamoyl)-N-[(2,4-dimethylphenyl)methyl]benzamide
CID 46587606
4-(cyclopropylsulfamoyl)-N-[2-(3,5-dimethylpiperidin-1-yl)ethyl]benzamide
CID 55723380

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-methylpropyl)-4-(cyclopropylsulfamoyl)benzamide?
The IUPAC name of N-(2-amino-2-methylpropyl)-4-(cyclopropylsulfamoyl)benzamide (CID 119628503) is N-(2-amino-2-methylpropyl)-4-(cyclopropylsulfamoyl)benzamide.
What is the SMILES notation for N-(2-amino-2-methylpropyl)-4-(cyclopropylsulfamoyl)benzamide?
The canonical SMILES for N-(2-amino-2-methylpropyl)-4-(cyclopropylsulfamoyl)benzamide is CC(C)(N)CNC(=O)c1ccc(S(=O)(=O)NC2CC2)cc1.
What is the InChIKey of N-(2-amino-2-methylpropyl)-4-(cyclopropylsulfamoyl)benzamide?
The InChIKey is XDLKLNXZCOODOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O3S/c1-14(2,15)9-16-13(18)10-3-7-12(8-4-10)21(19,20)17-11-5-6-11/h3-4,7-8,11,17H,5-6,9,15H2,1-2H3,(H,16,18).
What are the key properties of N-(2-amino-2-methylpropyl)-4-(cyclopropylsulfamoyl)benzamide?
N-(2-amino-2-methylpropyl)-4-(cyclopropylsulfamoyl)benzamide has a molecular weight of 311.41 g/mol, XLogP of 0.59, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-methylpropyl)-4-(cyclopropylsulfamoyl)benzamide is sourced from PubChem (CID 119628503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).