N-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-3-methylthiophene-2-carboxamide

C11H12N2O4S2 — CID 86997815

IUPACN-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-3-methylthiophene-2-carboxamide
SMILESCc1ccsc1C(=O)NS(=O)(=O)c1c(C)noc1C
InChIInChI=1S/C11H12N2O4S2/c1-6-4-5-18-9(6)11(14)13-19(15,16)10-7(2)12-17-8(10)3/h4-5H,1-3H3,(H,13,14)
InChIKeyGMLAEOMTXFRECS-UHFFFAOYSA-N
MW300.36 g/mol
LogP1.78
Rot. Bonds3

About N-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-3-methylthiophene-2-carboxamide

N-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-3-methylthiophene-2-carboxamide (PubChem CID 86997815) has the molecular formula C11H12N2O4S2 and a molecular weight of 300.36 g/mol. Its IUPAC name is N-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-3-methylthiophene-2-carboxamide.

Molecular Properties

Compound NameN-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-3-methylthiophene-2-carboxamide
PubChem CID86997815
Molecular FormulaC11H12N2O4S2
Molecular Weight300.36 g/mol
Exact Mass300.02
IUPAC NameN-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-3-methylthiophene-2-carboxamide
SMILESCc1ccsc1C(=O)NS(=O)(=O)c1c(C)noc1C
InChIInChI=1S/C11H12N2O4S2/c1-6-4-5-18-9(6)11(14)13-19(15,16)10-7(2)12-17-8(10)3/h4-5H,1-3H3,(H,13,14)
InChIKeyGMLAEOMTXFRECS-UHFFFAOYSA-N
XLogP1.78
TPSA89.27 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-3-methylthiophene-2-carboxamide 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-[(2,4-dimethyl-1,3-thiazol-5-yl)sulfonyl]-3-methylthiophene-2-carboxamide
CID 71981731
N-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-3-methyl-4-propan-2-ylbenzamide
CID 130428220
N-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-2,3-dihydro-1H-indene-5-carboxamide
CID 86997801
N-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-3-(4-fluorophenyl)-1H-pyrazole-5-carboxamide
CID 87011350
N-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-6-ethylsulfanylpyridine-3-carboxamide
CID 71933676
N-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-4-(5-methylthiophen-2-yl)-4-oxobutanamide
CID 87011344
[(3-methylthiophene-2-carbonyl)amino]urea
CID 63001953
N-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-2-(2,4,6-trimethylphenoxy)acetamide
CID 71894477
3,5-dimethyl-N-(2-oxopropyl)-1,2-oxazole-4-sulfonamide
CID 64994317
3,5-dimethyl-N-(2,3,5,6-tetramethylphenyl)-1,2-oxazole-4-sulfonamide
CID 110776931
2,2-dichloro-N-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]cyclopropane-1-carboxamide
CID 78895747
N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-3-methylthiophene-2-carboxamide
CID 47344953

Frequently Asked Questions

What is the IUPAC name of N-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-3-methylthiophene-2-carboxamide?
The IUPAC name of N-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-3-methylthiophene-2-carboxamide (CID 86997815) is N-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-3-methylthiophene-2-carboxamide.
What is the SMILES notation for N-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-3-methylthiophene-2-carboxamide?
The canonical SMILES for N-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-3-methylthiophene-2-carboxamide is Cc1ccsc1C(=O)NS(=O)(=O)c1c(C)noc1C.
What is the InChIKey of N-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-3-methylthiophene-2-carboxamide?
The InChIKey is GMLAEOMTXFRECS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O4S2/c1-6-4-5-18-9(6)11(14)13-19(15,16)10-7(2)12-17-8(10)3/h4-5H,1-3H3,(H,13,14).
What are the key properties of N-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-3-methylthiophene-2-carboxamide?
N-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-3-methylthiophene-2-carboxamide has a molecular weight of 300.36 g/mol, XLogP of 1.78, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-3-methylthiophene-2-carboxamide is sourced from PubChem (CID 86997815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).