5-chloro-1-methyl-N-(1-naphthalen-2-ylethyl)imidazole-4-sulfonamide

C16H16ClN3O2S — CID 134035693

IUPAC5-chloro-1-methyl-N-(1-naphthalen-2-ylethyl)imidazole-4-sulfonamide
SMILESCC(NS(=O)(=O)c1ncn(C)c1Cl)c1ccc2ccccc2c1
InChIInChI=1S/C16H16ClN3O2S/c1-11(13-8-7-12-5-3-4-6-14(12)9-13)19-23(21,22)16-15(17)20(2)10-18-16/h3-11,19H,1-2H3
InChIKeyATHQLNSBPDQCNM-UHFFFAOYSA-N
MW349.84 g/mol
LogP3.27
Rot. Bonds4

About 5-chloro-1-methyl-N-(1-naphthalen-2-ylethyl)imidazole-4-sulfonamide

5-chloro-1-methyl-N-(1-naphthalen-2-ylethyl)imidazole-4-sulfonamide (PubChem CID 134035693) has the molecular formula C16H16ClN3O2S and a molecular weight of 349.84 g/mol. Its IUPAC name is 5-chloro-1-methyl-N-(1-naphthalen-2-ylethyl)imidazole-4-sulfonamide.

Molecular Properties

Compound Name5-chloro-1-methyl-N-(1-naphthalen-2-ylethyl)imidazole-4-sulfonamide
PubChem CID134035693
Molecular FormulaC16H16ClN3O2S
Molecular Weight349.84 g/mol
Exact Mass349.07
IUPAC Name5-chloro-1-methyl-N-(1-naphthalen-2-ylethyl)imidazole-4-sulfonamide
SMILESCC(NS(=O)(=O)c1ncn(C)c1Cl)c1ccc2ccccc2c1
InChIInChI=1S/C16H16ClN3O2S/c1-11(13-8-7-12-5-3-4-6-14(12)9-13)19-23(21,22)16-15(17)20(2)10-18-16/h3-11,19H,1-2H3
InChIKeyATHQLNSBPDQCNM-UHFFFAOYSA-N
XLogP3.27
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.84
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-chloro-1-methyl-N-(1-naphthalen-2-ylethyl)imidazole-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

N-[1-(4-bromophenyl)ethyl]-5-chloro-1-methylimidazole-4-sulfonamide
CID 47164706
5-chloro-1-methyl-N-[(1S)-1-pyridin-4-ylethyl]imidazole-4-sulfonamide
CID 35305898
5-chloro-1-methyl-N-naphthalen-2-ylimidazole-4-sulfonamide
CID 60747502
N-[3-[1-[(5-chloro-1-methylimidazol-4-yl)sulfonylamino]ethyl]phenyl]acetamide
CID 46595981
5-chloro-1-methyl-N-[1-(1H-pyrazol-4-yl)ethyl]imidazole-4-sulfonamide
CID 103854127
naphthalen-2-yl 5-chloro-1-methylimidazole-4-sulfonate
CID 35292224
5-chloro-1-methyl-N-(3-propan-2-ylphenyl)imidazole-4-sulfonamide
CID 43415224
N-(1-naphthalen-2-ylethyl)methanesulfonamide
CID 3715918
1,3-dimethyl-N-(1-naphthalen-2-ylethyl)-2,4-dioxopyrimidine-5-sulfonamide
CID 51249055
5-chloro-1-methyl-N-[phenyl(pyridin-2-yl)methyl]imidazole-4-sulfonamide
CID 46595754
5-chloro-1-methyl-N-(3-methylpentan-2-yl)imidazole-4-sulfonamide
CID 61395268
5-chloro-N-(1-cyanopropan-2-yl)-1-methylimidazole-4-sulfonamide
CID 62091697

Frequently Asked Questions

What is the IUPAC name of 5-chloro-1-methyl-N-(1-naphthalen-2-ylethyl)imidazole-4-sulfonamide?
The IUPAC name of 5-chloro-1-methyl-N-(1-naphthalen-2-ylethyl)imidazole-4-sulfonamide (CID 134035693) is 5-chloro-1-methyl-N-(1-naphthalen-2-ylethyl)imidazole-4-sulfonamide.
What is the SMILES notation for 5-chloro-1-methyl-N-(1-naphthalen-2-ylethyl)imidazole-4-sulfonamide?
The canonical SMILES for 5-chloro-1-methyl-N-(1-naphthalen-2-ylethyl)imidazole-4-sulfonamide is CC(NS(=O)(=O)c1ncn(C)c1Cl)c1ccc2ccccc2c1.
What is the InChIKey of 5-chloro-1-methyl-N-(1-naphthalen-2-ylethyl)imidazole-4-sulfonamide?
The InChIKey is ATHQLNSBPDQCNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16ClN3O2S/c1-11(13-8-7-12-5-3-4-6-14(12)9-13)19-23(21,22)16-15(17)20(2)10-18-16/h3-11,19H,1-2H3.
What are the key properties of 5-chloro-1-methyl-N-(1-naphthalen-2-ylethyl)imidazole-4-sulfonamide?
5-chloro-1-methyl-N-(1-naphthalen-2-ylethyl)imidazole-4-sulfonamide has a molecular weight of 349.84 g/mol, XLogP of 3.27, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-1-methyl-N-(1-naphthalen-2-ylethyl)imidazole-4-sulfonamide is sourced from PubChem (CID 134035693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).