5-chloro-N-[2-(dimethylamino)-3-phenylpropyl]-1-methylimidazole-4-sulfonamide

C15H21ClN4O2S — CID 134035705

IUPAC5-chloro-N-[2-(dimethylamino)-3-phenylpropyl]-1-methylimidazole-4-sulfonamide
SMILESCN(C)C(CNS(=O)(=O)c1ncn(C)c1Cl)Cc1ccccc1
InChIInChI=1S/C15H21ClN4O2S/c1-19(2)13(9-12-7-5-4-6-8-12)10-18-23(21,22)15-14(16)20(3)11-17-15/h4-8,11,13,18H,9-10H2,1-3H3
InChIKeyVDPQJHCAWFWSMP-UHFFFAOYSA-N
MW356.88 g/mol
LogP1.52
Rot. Bonds7

About 5-chloro-N-[2-(dimethylamino)-3-phenylpropyl]-1-methylimidazole-4-sulfonamide

5-chloro-N-[2-(dimethylamino)-3-phenylpropyl]-1-methylimidazole-4-sulfonamide (PubChem CID 134035705) has the molecular formula C15H21ClN4O2S and a molecular weight of 356.88 g/mol. Its IUPAC name is 5-chloro-N-[2-(dimethylamino)-3-phenylpropyl]-1-methylimidazole-4-sulfonamide.

Molecular Properties

Compound Name5-chloro-N-[2-(dimethylamino)-3-phenylpropyl]-1-methylimidazole-4-sulfonamide
PubChem CID134035705
Molecular FormulaC15H21ClN4O2S
Molecular Weight356.88 g/mol
Exact Mass356.11
IUPAC Name5-chloro-N-[2-(dimethylamino)-3-phenylpropyl]-1-methylimidazole-4-sulfonamide
SMILESCN(C)C(CNS(=O)(=O)c1ncn(C)c1Cl)Cc1ccccc1
InChIInChI=1S/C15H21ClN4O2S/c1-19(2)13(9-12-7-5-4-6-8-12)10-18-23(21,22)15-14(16)20(3)11-17-15/h4-8,11,13,18H,9-10H2,1-3H3
InChIKeyVDPQJHCAWFWSMP-UHFFFAOYSA-N
XLogP1.52
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.88
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 5-chloro-N-[2-(dimethylamino)-3-phenylpropyl]-1-methylimidazole-4-sulfonamide 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

5-chloro-N-[(2S)-2-(dimethylamino)-2-thiophen-2-ylethyl]-1-methylimidazole-4-sulfonamide
CID 97046731
5-chloro-1-methyl-N-(2-phenyl-1-thiophen-2-ylethyl)imidazole-4-sulfonamide
CID 166209049
N-benzyl-5-chloro-N,1-dimethylimidazole-4-sulfonamide
CID 35288819
N-[2-(dimethylamino)-3-phenylpropyl]-2,6-difluorobenzenesulfonamide
CID 51169617
5-chloro-N-(2-methoxypropyl)-1-methylimidazole-4-sulfonamide
CID 102697795
5-chloro-N-(3-hydroxy-2-methylpropyl)-1-methylimidazole-4-sulfonamide
CID 65035723
N-[2-(dimethylamino)-3-phenylpropyl]-4-ethoxybenzenesulfonamide
CID 51169603
5-chloro-1-methyl-N-[(4-methylphenyl)methyl]imidazole-4-sulfonamide
CID 43415290
N-[2-(dimethylamino)-3-phenylpropyl]-4-propylbenzenesulfonamide
CID 55353812
4-N-cyclopropyl-1-N-[2-(dimethylamino)-3-phenylpropyl]benzene-1,4-disulfonamide
CID 55565428
N-[2-(dimethylamino)-3-phenylpropyl]-2-(trifluoromethoxy)benzenesulfonamide
CID 55511769
5-chloro-N-[[3-(methoxymethyl)phenyl]methyl]-1-methylimidazole-4-sulfonamide
CID 60527069

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-[2-(dimethylamino)-3-phenylpropyl]-1-methylimidazole-4-sulfonamide?
The IUPAC name of 5-chloro-N-[2-(dimethylamino)-3-phenylpropyl]-1-methylimidazole-4-sulfonamide (CID 134035705) is 5-chloro-N-[2-(dimethylamino)-3-phenylpropyl]-1-methylimidazole-4-sulfonamide.
What is the SMILES notation for 5-chloro-N-[2-(dimethylamino)-3-phenylpropyl]-1-methylimidazole-4-sulfonamide?
The canonical SMILES for 5-chloro-N-[2-(dimethylamino)-3-phenylpropyl]-1-methylimidazole-4-sulfonamide is CN(C)C(CNS(=O)(=O)c1ncn(C)c1Cl)Cc1ccccc1.
What is the InChIKey of 5-chloro-N-[2-(dimethylamino)-3-phenylpropyl]-1-methylimidazole-4-sulfonamide?
The InChIKey is VDPQJHCAWFWSMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21ClN4O2S/c1-19(2)13(9-12-7-5-4-6-8-12)10-18-23(21,22)15-14(16)20(3)11-17-15/h4-8,11,13,18H,9-10H2,1-3H3.
What are the key properties of 5-chloro-N-[2-(dimethylamino)-3-phenylpropyl]-1-methylimidazole-4-sulfonamide?
5-chloro-N-[2-(dimethylamino)-3-phenylpropyl]-1-methylimidazole-4-sulfonamide has a molecular weight of 356.88 g/mol, XLogP of 1.52, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-[2-(dimethylamino)-3-phenylpropyl]-1-methylimidazole-4-sulfonamide is sourced from PubChem (CID 134035705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).