2-[3-(methylamino)piperidin-1-yl]-N-(3-sulfamoylphenyl)propanamide;hydrochloride

C15H25ClN4O3S — CID 119918280

IUPAC2-[3-(methylamino)piperidin-1-yl]-N-(3-sulfamoylphenyl)propanamide;hydrochloride
SMILESCNC1CCCN(C(C)C(=O)Nc2cccc(S(N)(=O)=O)c2)C1.Cl
InChIInChI=1S/C15H24N4O3S.ClH/c1-11(19-8-4-6-13(10-19)17-2)15(20)18-12-5-3-7-14(9-12)23(16,21)22;/h3,5,7,9,11,13,17H,4,6,8,10H2,1-2H3,(H,18,20)(H2,16,21,22);1H
InChIKeyJKAPCKPZCYICRM-UHFFFAOYSA-N
MW376.91 g/mol
LogP0.77
Rot. Bonds5

About 2-[3-(methylamino)piperidin-1-yl]-N-(3-sulfamoylphenyl)propanamide;hydrochloride

2-[3-(methylamino)piperidin-1-yl]-N-(3-sulfamoylphenyl)propanamide;hydrochloride (PubChem CID 119918280) has the molecular formula C15H25ClN4O3S and a molecular weight of 376.91 g/mol. Its IUPAC name is 2-[3-(methylamino)piperidin-1-yl]-N-(3-sulfamoylphenyl)propanamide;hydrochloride.

Molecular Properties

Compound Name2-[3-(methylamino)piperidin-1-yl]-N-(3-sulfamoylphenyl)propanamide;hydrochloride
PubChem CID119918280
Molecular FormulaC15H25ClN4O3S
Molecular Weight376.91 g/mol
Exact Mass376.13
IUPAC Name2-[3-(methylamino)piperidin-1-yl]-N-(3-sulfamoylphenyl)propanamide;hydrochloride
SMILESCNC1CCCN(C(C)C(=O)Nc2cccc(S(N)(=O)=O)c2)C1.Cl
InChIInChI=1S/C15H24N4O3S.ClH/c1-11(19-8-4-6-13(10-19)17-2)15(20)18-12-5-3-7-14(9-12)23(16,21)22;/h3,5,7,9,11,13,17H,4,6,8,10H2,1-2H3,(H,18,20)(H2,16,21,22);1H
InChIKeyJKAPCKPZCYICRM-UHFFFAOYSA-N
XLogP0.77
TPSA104.53 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.91
LogP ≤ 50.77
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 2-[3-(methylamino)piperidin-1-yl]-N-(3-sulfamoylphenyl)propanamide;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

2-[3-(methylamino)piperidin-1-yl]-N-(4-sulfamoylphenyl)propanamide;hydrochloride
CID 119918352
(2R)-2-(azepan-1-yl)-N-(3-sulfamoylphenyl)propanamide
CID 41023511
N-(3-chlorophenyl)-2-[3-(methylamino)piperidin-1-yl]propanamide;hydrochloride
CID 119918800
2-[3-(methylamino)piperidin-1-yl]-N-[3-(2-oxopyrrolidin-1-yl)phenyl]propanamide;hydrochloride
CID 119919119
4-[2-[3-(methylamino)piperidin-1-yl]propanoylamino]benzamide
CID 119920088
3-[3-(methylamino)piperidin-1-yl]-N-(3-sulfamoylphenyl)propanamide;hydrochloride
CID 119919395
N-(2,6-difluorophenyl)-2-[3-(methylamino)piperidin-1-yl]propanamide;hydrochloride
CID 119918498
(2S)-2-(4-phenylpiperazin-1-yl)-N-(3-sulfamoylphenyl)propanamide
CID 9250166
(3S)-1-[(2S)-1-oxo-1-(4-sulfamoylanilino)propan-2-yl]-N-phenylpiperidine-3-carboxamide
CID 51672985
2-[3-(methylamino)piperidin-1-yl]-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)propanamide
CID 119918874
3-methyl-N-(3-sulfamoylphenyl)piperidine-1-carboxamide
CID 47185999
(3S)-3-methyl-N-(3-sulfamoylphenyl)piperidine-1-carboxamide
CID 38150508

Frequently Asked Questions

What is the IUPAC name of 2-[3-(methylamino)piperidin-1-yl]-N-(3-sulfamoylphenyl)propanamide;hydrochloride?
The IUPAC name of 2-[3-(methylamino)piperidin-1-yl]-N-(3-sulfamoylphenyl)propanamide;hydrochloride (CID 119918280) is 2-[3-(methylamino)piperidin-1-yl]-N-(3-sulfamoylphenyl)propanamide;hydrochloride.
What is the SMILES notation for 2-[3-(methylamino)piperidin-1-yl]-N-(3-sulfamoylphenyl)propanamide;hydrochloride?
The canonical SMILES for 2-[3-(methylamino)piperidin-1-yl]-N-(3-sulfamoylphenyl)propanamide;hydrochloride is CNC1CCCN(C(C)C(=O)Nc2cccc(S(N)(=O)=O)c2)C1.Cl.
What is the InChIKey of 2-[3-(methylamino)piperidin-1-yl]-N-(3-sulfamoylphenyl)propanamide;hydrochloride?
The InChIKey is JKAPCKPZCYICRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O3S.ClH/c1-11(19-8-4-6-13(10-19)17-2)15(20)18-12-5-3-7-14(9-12)23(16,21)22;/h3,5,7,9,11,13,17H,4,6,8,10H2,1-2H3,(H,18,20)(H2,16,21,22);1H.
What are the key properties of 2-[3-(methylamino)piperidin-1-yl]-N-(3-sulfamoylphenyl)propanamide;hydrochloride?
2-[3-(methylamino)piperidin-1-yl]-N-(3-sulfamoylphenyl)propanamide;hydrochloride has a molecular weight of 376.91 g/mol, XLogP of 0.77, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(methylamino)piperidin-1-yl]-N-(3-sulfamoylphenyl)propanamide;hydrochloride is sourced from PubChem (CID 119918280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).