N-(1-aminohexan-2-yl)-4-(methylsulfamoyl)thiophene-2-carboxamide;hydrochloride

C12H22ClN3O3S2 — CID 119668329

IUPACN-(1-aminohexan-2-yl)-4-(methylsulfamoyl)thiophene-2-carboxamide;hydrochloride
SMILESCCCCC(CN)NC(=O)c1cc(S(=O)(=O)NC)cs1.Cl
InChIInChI=1S/C12H21N3O3S2.ClH/c1-3-4-5-9(7-13)15-12(16)11-6-10(8-19-11)20(17,18)14-2;/h6,8-9,14H,3-5,7,13H2,1-2H3,(H,15,16);1H
InChIKeyUPRKSSFQDMVPGZ-UHFFFAOYSA-N
MW355.91 g/mol
LogP1.33
Rot. Bonds8

About N-(1-aminohexan-2-yl)-4-(methylsulfamoyl)thiophene-2-carboxamide;hydrochloride

N-(1-aminohexan-2-yl)-4-(methylsulfamoyl)thiophene-2-carboxamide;hydrochloride (PubChem CID 119668329) has the molecular formula C12H22ClN3O3S2 and a molecular weight of 355.91 g/mol. Its IUPAC name is N-(1-aminohexan-2-yl)-4-(methylsulfamoyl)thiophene-2-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(1-aminohexan-2-yl)-4-(methylsulfamoyl)thiophene-2-carboxamide;hydrochloride
PubChem CID119668329
Molecular FormulaC12H22ClN3O3S2
Molecular Weight355.91 g/mol
Exact Mass355.08
IUPAC NameN-(1-aminohexan-2-yl)-4-(methylsulfamoyl)thiophene-2-carboxamide;hydrochloride
SMILESCCCCC(CN)NC(=O)c1cc(S(=O)(=O)NC)cs1.Cl
InChIInChI=1S/C12H21N3O3S2.ClH/c1-3-4-5-9(7-13)15-12(16)11-6-10(8-19-11)20(17,18)14-2;/h6,8-9,14H,3-5,7,13H2,1-2H3,(H,15,16);1H
InChIKeyUPRKSSFQDMVPGZ-UHFFFAOYSA-N
XLogP1.33
TPSA101.29 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.91
LogP ≤ 51.33
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze N-(1-aminohexan-2-yl)-4-(methylsulfamoyl)thiophene-2-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-(1-amino-4-methylpentan-2-yl)-4-(methylsulfamoyl)thiophene-2-carboxamide;hydrochloride
CID 119588415
N-(1-aminohexan-2-yl)-1-benzothiophene-2-carboxamide;hydrochloride
CID 119665559
3-N-(1-aminohexan-2-yl)-1-N-methylbenzene-1,3-dicarboxamide;hydrochloride
CID 119668834
N-(1-aminohexan-2-yl)-3,5-dimethylbenzamide
CID 80697654
N-(1-aminohexan-2-yl)-2-ethylsulfonylbenzamide;hydrochloride
CID 119667537
N-(1-aminohexan-2-yl)-3-chlorobenzamide;hydrochloride
CID 119667644
N-(1-aminohexan-2-yl)-3-(thiophen-2-ylsulfonylamino)benzamide;hydrochloride
CID 119667025
N-(1-aminohexan-2-yl)-3-methylthiophene-2-carboxamide
CID 80697346
N-(1-aminohexan-2-yl)-4-chloro-2-fluorobenzamide;hydrochloride
CID 119665363
N-(1-aminohexan-2-yl)-2-pyridin-4-yl-1,3-thiazole-5-carboxamide
CID 119665216
N-(1-aminohexan-2-yl)-4-bromo-2,6-difluorobenzamide;hydrochloride
CID 119665762
N-(1-aminohexan-2-yl)-3-methylbenzamide;hydrochloride
CID 119667380

Frequently Asked Questions

What is the IUPAC name of N-(1-aminohexan-2-yl)-4-(methylsulfamoyl)thiophene-2-carboxamide;hydrochloride?
The IUPAC name of N-(1-aminohexan-2-yl)-4-(methylsulfamoyl)thiophene-2-carboxamide;hydrochloride (CID 119668329) is N-(1-aminohexan-2-yl)-4-(methylsulfamoyl)thiophene-2-carboxamide;hydrochloride.
What is the SMILES notation for N-(1-aminohexan-2-yl)-4-(methylsulfamoyl)thiophene-2-carboxamide;hydrochloride?
The canonical SMILES for N-(1-aminohexan-2-yl)-4-(methylsulfamoyl)thiophene-2-carboxamide;hydrochloride is CCCCC(CN)NC(=O)c1cc(S(=O)(=O)NC)cs1.Cl.
What is the InChIKey of N-(1-aminohexan-2-yl)-4-(methylsulfamoyl)thiophene-2-carboxamide;hydrochloride?
The InChIKey is UPRKSSFQDMVPGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O3S2.ClH/c1-3-4-5-9(7-13)15-12(16)11-6-10(8-19-11)20(17,18)14-2;/h6,8-9,14H,3-5,7,13H2,1-2H3,(H,15,16);1H.
What are the key properties of N-(1-aminohexan-2-yl)-4-(methylsulfamoyl)thiophene-2-carboxamide;hydrochloride?
N-(1-aminohexan-2-yl)-4-(methylsulfamoyl)thiophene-2-carboxamide;hydrochloride has a molecular weight of 355.91 g/mol, XLogP of 1.33, 8 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-aminohexan-2-yl)-4-(methylsulfamoyl)thiophene-2-carboxamide;hydrochloride is sourced from PubChem (CID 119668329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).