1-phenyl-N-[(2-thiophen-2-yl-1,3-thiazol-4-yl)methyl]methanesulfonamide

C15H14N2O2S3 — CID 2738760

IUPAC1-phenyl-N-[(2-thiophen-2-yl-1,3-thiazol-4-yl)methyl]methanesulfonamide
SMILESO=S(=O)(Cc1ccccc1)NCc1csc(-c2cccs2)n1
InChIInChI=1S/C15H14N2O2S3/c18-22(19,11-12-5-2-1-3-6-12)16-9-13-10-21-15(17-13)14-7-4-8-20-14/h1-8,10,16H,9,11H2
InChIKeyAWPRKXFLNXDFOP-UHFFFAOYSA-N
MW350.49 g/mol
LogP3.49
Rot. Bonds6

About 1-phenyl-N-[(2-thiophen-2-yl-1,3-thiazol-4-yl)methyl]methanesulfonamide

1-phenyl-N-[(2-thiophen-2-yl-1,3-thiazol-4-yl)methyl]methanesulfonamide (PubChem CID 2738760) has the molecular formula C15H14N2O2S3 and a molecular weight of 350.49 g/mol. Its IUPAC name is 1-phenyl-N-[(2-thiophen-2-yl-1,3-thiazol-4-yl)methyl]methanesulfonamide.

Molecular Properties

Compound Name1-phenyl-N-[(2-thiophen-2-yl-1,3-thiazol-4-yl)methyl]methanesulfonamide
PubChem CID2738760
Molecular FormulaC15H14N2O2S3
Molecular Weight350.49 g/mol
Exact Mass350.02
IUPAC Name1-phenyl-N-[(2-thiophen-2-yl-1,3-thiazol-4-yl)methyl]methanesulfonamide
SMILESO=S(=O)(Cc1ccccc1)NCc1csc(-c2cccs2)n1
InChIInChI=1S/C15H14N2O2S3/c18-22(19,11-12-5-2-1-3-6-12)16-9-13-10-21-15(17-13)14-7-4-8-20-14/h1-8,10,16H,9,11H2
InChIKeyAWPRKXFLNXDFOP-UHFFFAOYSA-N
XLogP3.49
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.49
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-phenyl-N-[(2-thiophen-2-yl-1,3-thiazol-4-yl)methyl]methanesulfonamide 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-phenyl-4-[(2-thiophen-2-yl-1,3-thiazol-4-yl)methylamino]pentanoic acid
CID 120512015
5-pyridin-2-yl-N-[(2-thiophen-2-yl-1,3-thiazol-4-yl)methyl]thiophene-2-sulfonamide
CID 2738763
3-[(2-thiophen-2-yl-1,3-thiazol-4-yl)methylamino]propanoic acid
CID 120913165
N-(furan-3-ylmethyl)-2H-pyrazolo[3,4-b]pyridine-3-sulfonamide;N-[(2-thiophen-2-yl-1,3-thiazol-4-yl)methyl]-2H-pyrazolo[3,4-b]pyridine-3-sulfonamide
CID 159760435
N-[(2-thiophen-2-yl-1,3-thiazol-4-yl)methyl]butan-2-amine
CID 82515815
2-methyl-N-[(2-thiophen-2-yl-1,3-thiazol-4-yl)methyl]cyclopropan-1-amine
CID 115614557
1-(3-methylphenyl)-N-[(4-methyl-2-thiophen-2-yl-1,3-thiazol-5-yl)methyl]methanesulfonamide
CID 121121878
1-phenyl-N-[(4-propan-2-yl-1,3-thiazol-2-yl)methyl]methanesulfonamide
CID 110446173
2-methoxy-N-[(2-thiophen-2-yl-1,3-thiazol-4-yl)methyl]ethanamine
CID 82515813
N-[(2-methyl-1,3-thiazol-4-yl)methyl]-2-phenylethanesulfonamide
CID 47319374
N-[(2-thiophen-2-yl-1,3-thiazol-4-yl)methyl]cyclohexanecarboxamide
CID 2738811
1-(1-hydroxy-2-methylpropan-2-yl)-3-[(2-thiophen-2-yl-1,3-thiazol-4-yl)methyl]urea
CID 121495515

Frequently Asked Questions

What is the IUPAC name of 1-phenyl-N-[(2-thiophen-2-yl-1,3-thiazol-4-yl)methyl]methanesulfonamide?
The IUPAC name of 1-phenyl-N-[(2-thiophen-2-yl-1,3-thiazol-4-yl)methyl]methanesulfonamide (CID 2738760) is 1-phenyl-N-[(2-thiophen-2-yl-1,3-thiazol-4-yl)methyl]methanesulfonamide.
What is the SMILES notation for 1-phenyl-N-[(2-thiophen-2-yl-1,3-thiazol-4-yl)methyl]methanesulfonamide?
The canonical SMILES for 1-phenyl-N-[(2-thiophen-2-yl-1,3-thiazol-4-yl)methyl]methanesulfonamide is O=S(=O)(Cc1ccccc1)NCc1csc(-c2cccs2)n1.
What is the InChIKey of 1-phenyl-N-[(2-thiophen-2-yl-1,3-thiazol-4-yl)methyl]methanesulfonamide?
The InChIKey is AWPRKXFLNXDFOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O2S3/c18-22(19,11-12-5-2-1-3-6-12)16-9-13-10-21-15(17-13)14-7-4-8-20-14/h1-8,10,16H,9,11H2.
What are the key properties of 1-phenyl-N-[(2-thiophen-2-yl-1,3-thiazol-4-yl)methyl]methanesulfonamide?
1-phenyl-N-[(2-thiophen-2-yl-1,3-thiazol-4-yl)methyl]methanesulfonamide has a molecular weight of 350.49 g/mol, XLogP of 3.49, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-N-[(2-thiophen-2-yl-1,3-thiazol-4-yl)methyl]methanesulfonamide is sourced from PubChem (CID 2738760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).