5-chloro-N-(4,6-dimethylpyrimidin-2-yl)thiophene-2-carboxamide

C11H10ClN3OS — CID 2970310

IUPAC5-chloro-N-(4,6-dimethylpyrimidin-2-yl)thiophene-2-carboxamide
SMILESCc1cc(C)nc(NC(=O)c2ccc(Cl)s2)n1
InChIInChI=1S/C11H10ClN3OS/c1-6-5-7(2)14-11(13-6)15-10(16)8-3-4-9(12)17-8/h3-5H,1-2H3,(H,13,14,15,16)
InChIKeyCSKDEYBAIURZHO-UHFFFAOYSA-N
MW267.74 g/mol
LogP3.06
Rot. Bonds2

About 5-chloro-N-(4,6-dimethylpyrimidin-2-yl)thiophene-2-carboxamide

5-chloro-N-(4,6-dimethylpyrimidin-2-yl)thiophene-2-carboxamide (PubChem CID 2970310) has the molecular formula C11H10ClN3OS and a molecular weight of 267.74 g/mol. Its IUPAC name is 5-chloro-N-(4,6-dimethylpyrimidin-2-yl)thiophene-2-carboxamide.

Molecular Properties

Compound Name5-chloro-N-(4,6-dimethylpyrimidin-2-yl)thiophene-2-carboxamide
PubChem CID2970310
Molecular FormulaC11H10ClN3OS
Molecular Weight267.74 g/mol
Exact Mass267.02
IUPAC Name5-chloro-N-(4,6-dimethylpyrimidin-2-yl)thiophene-2-carboxamide
SMILESCc1cc(C)nc(NC(=O)c2ccc(Cl)s2)n1
InChIInChI=1S/C11H10ClN3OS/c1-6-5-7(2)14-11(13-6)15-10(16)8-3-4-9(12)17-8/h3-5H,1-2H3,(H,13,14,15,16)
InChIKeyCSKDEYBAIURZHO-UHFFFAOYSA-N
XLogP3.06
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.74
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-chloro-N-(4,6-dimethylpyrimidin-2-yl)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

N-(4,6-dimethylpyrimidin-2-yl)-2-(thiophen-2-yl)acetamide
CID 646401
N-(4,6-dimethylpyrimidin-2-yl)thiophene-2-carboxamide
CID 1147602
5-bromo-N-(4,6-dimethyl-2-pyrimidinyl)-2-thiophenecarboxamide
CID 2970730
5-chloro-N-{2-[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]ethyl}thiophene-2-carboxamide
CID 71796965
(5-Chlorothiophen-2-yl)(4-(2-methyl-6-(trifluoromethyl)pyrimidin-4-yl)piperazin-1-yl)methanone
CID 91631645
N-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]thiophene-2-carboxamide
CID 914056
N-(6-methyl-2-pyridyl)(5-chloro-2-thienyl)acetamide
CID 40805013
N-[4,6-bis(4-chlorophenyl)pyrimidin-2-yl]thiophene-2-carboxamide
CID 20896251
Urea, 1-(4-methyl-6-trifluoromethylpyrimidin-2-yl)-3-(thiophene-2-carbonyl)-
CID 1503225
4-chloro-5-methyl-N-[6-(trifluoromethyl)pyridin-2-yl]thiophene-2-carboxamide
CID 70856465
4-chloro-N-(6-fluoro-2-pyridinyl)-5-methylthiophene-2-carboxamide
CID 89945962
4-chloro-5-ethyl-N-[6-(trifluoromethyl)pyridin-2-yl]thiophene-2-carboxamide
CID 118527645

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(4,6-dimethylpyrimidin-2-yl)thiophene-2-carboxamide?
The IUPAC name of 5-chloro-N-(4,6-dimethylpyrimidin-2-yl)thiophene-2-carboxamide (CID 2970310) is 5-chloro-N-(4,6-dimethylpyrimidin-2-yl)thiophene-2-carboxamide.
What is the SMILES notation for 5-chloro-N-(4,6-dimethylpyrimidin-2-yl)thiophene-2-carboxamide?
The canonical SMILES for 5-chloro-N-(4,6-dimethylpyrimidin-2-yl)thiophene-2-carboxamide is Cc1cc(C)nc(NC(=O)c2ccc(Cl)s2)n1.
What is the InChIKey of 5-chloro-N-(4,6-dimethylpyrimidin-2-yl)thiophene-2-carboxamide?
The InChIKey is CSKDEYBAIURZHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10ClN3OS/c1-6-5-7(2)14-11(13-6)15-10(16)8-3-4-9(12)17-8/h3-5H,1-2H3,(H,13,14,15,16).
What are the key properties of 5-chloro-N-(4,6-dimethylpyrimidin-2-yl)thiophene-2-carboxamide?
5-chloro-N-(4,6-dimethylpyrimidin-2-yl)thiophene-2-carboxamide has a molecular weight of 267.74 g/mol, XLogP of 3.06, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(4,6-dimethylpyrimidin-2-yl)thiophene-2-carboxamide is sourced from PubChem (CID 2970310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).