N-(1-amino-2-cyclopropylpropan-2-yl)-3-(thiophen-2-ylsulfonylamino)benzamide

C17H21N3O3S2 — CID 119574325

IUPACN-(1-amino-2-cyclopropylpropan-2-yl)-3-(thiophen-2-ylsulfonylamino)benzamide
SMILESCC(CN)(NC(=O)c1cccc(NS(=O)(=O)c2cccs2)c1)C1CC1
InChIInChI=1S/C17H21N3O3S2/c1-17(11-18,13-7-8-13)19-16(21)12-4-2-5-14(10-12)20-25(22,23)15-6-3-9-24-15/h2-6,9-10,13,20H,7-8,11,18H2,1H3,(H,19,21)
InChIKeyNWZZRKPTQMZNJK-UHFFFAOYSA-N
MW379.51 g/mol
LogP2.41
Rot. Bonds7

About N-(1-amino-2-cyclopropylpropan-2-yl)-3-(thiophen-2-ylsulfonylamino)benzamide

N-(1-amino-2-cyclopropylpropan-2-yl)-3-(thiophen-2-ylsulfonylamino)benzamide (PubChem CID 119574325) has the molecular formula C17H21N3O3S2 and a molecular weight of 379.51 g/mol. Its IUPAC name is N-(1-amino-2-cyclopropylpropan-2-yl)-3-(thiophen-2-ylsulfonylamino)benzamide.

Molecular Properties

Compound NameN-(1-amino-2-cyclopropylpropan-2-yl)-3-(thiophen-2-ylsulfonylamino)benzamide
PubChem CID119574325
Molecular FormulaC17H21N3O3S2
Molecular Weight379.51 g/mol
Exact Mass379.10
IUPAC NameN-(1-amino-2-cyclopropylpropan-2-yl)-3-(thiophen-2-ylsulfonylamino)benzamide
SMILESCC(CN)(NC(=O)c1cccc(NS(=O)(=O)c2cccs2)c1)C1CC1
InChIInChI=1S/C17H21N3O3S2/c1-17(11-18,13-7-8-13)19-16(21)12-4-2-5-14(10-12)20-25(22,23)15-6-3-9-24-15/h2-6,9-10,13,20H,7-8,11,18H2,1H3,(H,19,21)
InChIKeyNWZZRKPTQMZNJK-UHFFFAOYSA-N
XLogP2.41
TPSA101.29 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.51
LogP ≤ 52.41
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze N-(1-amino-2-cyclopropylpropan-2-yl)-3-(thiophen-2-ylsulfonylamino)benzamide 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-[2-(aminomethyl)cyclohexyl]-3-(thiophen-2-ylsulfonylamino)benzamide;hydrochloride
CID 119611057
N-[2-(aminomethyl)cyclopentyl]-3-(thiophen-2-ylsulfonylamino)benzamide;hydrochloride
CID 119603184
N-(1-amino-2-cyclopropylpropan-2-yl)-3-(dimethylcarbamoylamino)benzamide
CID 119574828
N-(3-amino-2-methylpropyl)-3-(thiophen-2-ylsulfonylamino)benzamide;hydrochloride
CID 119995200
N-(1-hydroxypropan-2-yl)-3-(thiophen-2-ylsulfonylamino)benzamide
CID 78896710
N-[3-methyl-2-(4-methylpiperidin-1-yl)butyl]-3-(thiophen-2-ylsulfonylamino)benzamide
CID 60510665
N-pentyl-3-(thiophen-2-ylsulfonylamino)benzamide
CID 55786585
N-[2-(methylamino)propyl]-3-(thiophen-2-ylsulfonylamino)benzamide
CID 120826976
N-[3-(methylamino)propyl]-3-(thiophen-2-ylsulfonylamino)benzamide;hydrochloride
CID 119432119
N-(1-amino-2-cyclopropylpropan-2-yl)-3-cyanobenzamide
CID 113283477
N-(8-azabicyclo[3.2.1]octan-3-yl)-3-(thiophen-2-ylsulfonylamino)benzamide;hydrochloride
CID 119457637
N-(1-aminohexan-2-yl)-3-(thiophen-2-ylsulfonylamino)benzamide;hydrochloride
CID 119667025

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-2-cyclopropylpropan-2-yl)-3-(thiophen-2-ylsulfonylamino)benzamide?
The IUPAC name of N-(1-amino-2-cyclopropylpropan-2-yl)-3-(thiophen-2-ylsulfonylamino)benzamide (CID 119574325) is N-(1-amino-2-cyclopropylpropan-2-yl)-3-(thiophen-2-ylsulfonylamino)benzamide.
What is the SMILES notation for N-(1-amino-2-cyclopropylpropan-2-yl)-3-(thiophen-2-ylsulfonylamino)benzamide?
The canonical SMILES for N-(1-amino-2-cyclopropylpropan-2-yl)-3-(thiophen-2-ylsulfonylamino)benzamide is CC(CN)(NC(=O)c1cccc(NS(=O)(=O)c2cccs2)c1)C1CC1.
What is the InChIKey of N-(1-amino-2-cyclopropylpropan-2-yl)-3-(thiophen-2-ylsulfonylamino)benzamide?
The InChIKey is NWZZRKPTQMZNJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O3S2/c1-17(11-18,13-7-8-13)19-16(21)12-4-2-5-14(10-12)20-25(22,23)15-6-3-9-24-15/h2-6,9-10,13,20H,7-8,11,18H2,1H3,(H,19,21).
What are the key properties of N-(1-amino-2-cyclopropylpropan-2-yl)-3-(thiophen-2-ylsulfonylamino)benzamide?
N-(1-amino-2-cyclopropylpropan-2-yl)-3-(thiophen-2-ylsulfonylamino)benzamide has a molecular weight of 379.51 g/mol, XLogP of 2.41, 7 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-2-cyclopropylpropan-2-yl)-3-(thiophen-2-ylsulfonylamino)benzamide is sourced from PubChem (CID 119574325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).