4,5-dibromo-N-(4-methyl-3-pyridinyl)thiophene-2-carboxamide

C11H8Br2N2OS — CID 78941963

IUPAC4,5-dibromo-N-(4-methyl-3-pyridinyl)thiophene-2-carboxamide
SMILESCc1ccncc1NC(=O)c1cc(Br)c(Br)s1
InChIInChI=1S/C11H8Br2N2OS/c1-6-2-3-14-5-8(6)15-11(16)9-4-7(12)10(13)17-9/h2-5H,1H3,(H,15,16)
InChIKeyKJUPYGOTWGHAPO-UHFFFAOYSA-N
MW376.07 g/mol
LogP4.23
Rot. Bonds2

About 4,5-dibromo-N-(4-methyl-3-pyridinyl)thiophene-2-carboxamide

4,5-dibromo-N-(4-methyl-3-pyridinyl)thiophene-2-carboxamide (PubChem CID 78941963) has the molecular formula C11H8Br2N2OS and a molecular weight of 376.07 g/mol. Its IUPAC name is 4,5-dibromo-N-(4-methyl-3-pyridinyl)thiophene-2-carboxamide.

Molecular Properties

Compound Name4,5-dibromo-N-(4-methyl-3-pyridinyl)thiophene-2-carboxamide
PubChem CID78941963
Molecular FormulaC11H8Br2N2OS
Molecular Weight376.07 g/mol
Exact Mass373.87
IUPAC Name4,5-dibromo-N-(4-methyl-3-pyridinyl)thiophene-2-carboxamide
SMILESCc1ccncc1NC(=O)c1cc(Br)c(Br)s1
InChIInChI=1S/C11H8Br2N2OS/c1-6-2-3-14-5-8(6)15-11(16)9-4-7(12)10(13)17-9/h2-5H,1H3,(H,15,16)
InChIKeyKJUPYGOTWGHAPO-UHFFFAOYSA-N
XLogP4.23
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.07
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4,5-dibromo-N-(4-methyl-3-pyridinyl)thiophene-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

5-bromo-4-methyl-N-(4-methyl-3-pyridinyl)thiophene-2-carboxamide
CID 79941495
4,5-dibromo-N-isoquinolin-5-ylthiophene-2-carboxamide
CID 29371541
3-[(4,5-dibromothiophene-2-carbonyl)amino]-4-methylbenzoic acid
CID 43239573
4,5-dibromo-N-(3,4-dimethylphenyl)thiophene-2-carboxamide
CID 54557430
2,5-dibromo-N-(4-methyl-3-pyridinyl)benzamide
CID 114372326
4,5-dibromo-N-(1,5-dimethylpyrazol-4-yl)thiophene-2-carboxamide
CID 4773000
5-(3-aminoprop-1-ynyl)-4-methyl-N-(4-methyl-3-pyridinyl)thiophene-2-carboxamide
CID 79989819
4,5-dibromo-N-(2-fluoro-5-methylphenyl)thiophene-2-carboxamide
CID 42971041
4,5-dibromo-N-(6-bromo-5-methyl-3-pyridinyl)thiophene-2-carboxamide
CID 114050470
1,3-bis(4-methyl-3-pyridinyl)urea
CID 86818735
4,5-dibromo-N-(2-tert-butylphenyl)thiophene-2-carboxamide
CID 78906422
4-bromo-N-(4-methyl-3-pyridinyl)-1H-pyrrole-2-carboxamide
CID 55220101

Frequently Asked Questions

What is the IUPAC name of 4,5-dibromo-N-(4-methyl-3-pyridinyl)thiophene-2-carboxamide?
The IUPAC name of 4,5-dibromo-N-(4-methyl-3-pyridinyl)thiophene-2-carboxamide (CID 78941963) is 4,5-dibromo-N-(4-methyl-3-pyridinyl)thiophene-2-carboxamide.
What is the SMILES notation for 4,5-dibromo-N-(4-methyl-3-pyridinyl)thiophene-2-carboxamide?
The canonical SMILES for 4,5-dibromo-N-(4-methyl-3-pyridinyl)thiophene-2-carboxamide is Cc1ccncc1NC(=O)c1cc(Br)c(Br)s1.
What is the InChIKey of 4,5-dibromo-N-(4-methyl-3-pyridinyl)thiophene-2-carboxamide?
The InChIKey is KJUPYGOTWGHAPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8Br2N2OS/c1-6-2-3-14-5-8(6)15-11(16)9-4-7(12)10(13)17-9/h2-5H,1H3,(H,15,16).
What are the key properties of 4,5-dibromo-N-(4-methyl-3-pyridinyl)thiophene-2-carboxamide?
4,5-dibromo-N-(4-methyl-3-pyridinyl)thiophene-2-carboxamide has a molecular weight of 376.07 g/mol, XLogP of 4.23, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-dibromo-N-(4-methyl-3-pyridinyl)thiophene-2-carboxamide is sourced from PubChem (CID 78941963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).