2-methyl-N-(2-methyl-4-pyridinyl)-1,3-thiazole-4-carboxamide

C11H11N3OS — CID 110465342

IUPAC2-methyl-N-(2-methyl-4-pyridinyl)-1,3-thiazole-4-carboxamide
SMILESCc1cc(NC(=O)c2csc(C)n2)ccn1
InChIInChI=1S/C11H11N3OS/c1-7-5-9(3-4-12-7)14-11(15)10-6-16-8(2)13-10/h3-6H,1-2H3,(H,12,14,15)
InChIKeyJWWLHRNOTKXLBX-UHFFFAOYSA-N
MW233.30 g/mol
LogP2.41
Rot. Bonds2

About 2-methyl-N-(2-methyl-4-pyridinyl)-1,3-thiazole-4-carboxamide

2-methyl-N-(2-methyl-4-pyridinyl)-1,3-thiazole-4-carboxamide (PubChem CID 110465342) has the molecular formula C11H11N3OS and a molecular weight of 233.30 g/mol. Its IUPAC name is 2-methyl-N-(2-methyl-4-pyridinyl)-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound Name2-methyl-N-(2-methyl-4-pyridinyl)-1,3-thiazole-4-carboxamide
PubChem CID110465342
Molecular FormulaC11H11N3OS
Molecular Weight233.30 g/mol
Exact Mass233.06
IUPAC Name2-methyl-N-(2-methyl-4-pyridinyl)-1,3-thiazole-4-carboxamide
SMILESCc1cc(NC(=O)c2csc(C)n2)ccn1
InChIInChI=1S/C11H11N3OS/c1-7-5-9(3-4-12-7)14-11(15)10-6-16-8(2)13-10/h3-6H,1-2H3,(H,12,14,15)
InChIKeyJWWLHRNOTKXLBX-UHFFFAOYSA-N
XLogP2.41
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.30
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-methyl-4-pyridinyl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide
CID 110463240
N-(3-amino-4-methylphenyl)-2-methyl-1,3-thiazole-4-carboxamide
CID 65199836
N-(4-amino-3-chlorophenyl)-2-methyl-1,3-thiazole-4-carboxamide
CID 82861418
N-(3-ethynylphenyl)-2-methyl-1,3-thiazole-4-carboxamide
CID 47443678
2-methyl-N-(4-methyl-3-sulfamoylphenyl)-1,3-thiazole-4-carboxamide
CID 47445064
5-(3-aminoprop-1-ynyl)-N-(2-methyl-4-pyridinyl)pyridine-2-carboxamide
CID 79241057
2,5-dimethyl-N-(2-methyl-4-pyridinyl)thiophene-3-carboxamide
CID 110705565
2-methyl-N-(2-methyl-1,3-dihydroisoindol-5-yl)-1,3-thiazole-4-carboxamide
CID 110465368
5-(aminomethyl)-N-(2-methyl-4-pyridinyl)pyridine-2-carboxamide
CID 79234754
N-(2-methoxyquinolin-6-yl)-2-methyl-1,3-thiazole-4-carboxamide
CID 86883645
4-(methylamino)-N-(2-methyl-4-pyridinyl)benzamide
CID 79240980
2-methyl-N-(6-methyl-2-pyridinyl)-1,3-thiazole-4-carboxamide
CID 47445423

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(2-methyl-4-pyridinyl)-1,3-thiazole-4-carboxamide?
The IUPAC name of 2-methyl-N-(2-methyl-4-pyridinyl)-1,3-thiazole-4-carboxamide (CID 110465342) is 2-methyl-N-(2-methyl-4-pyridinyl)-1,3-thiazole-4-carboxamide.
What is the SMILES notation for 2-methyl-N-(2-methyl-4-pyridinyl)-1,3-thiazole-4-carboxamide?
The canonical SMILES for 2-methyl-N-(2-methyl-4-pyridinyl)-1,3-thiazole-4-carboxamide is Cc1cc(NC(=O)c2csc(C)n2)ccn1.
What is the InChIKey of 2-methyl-N-(2-methyl-4-pyridinyl)-1,3-thiazole-4-carboxamide?
The InChIKey is JWWLHRNOTKXLBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N3OS/c1-7-5-9(3-4-12-7)14-11(15)10-6-16-8(2)13-10/h3-6H,1-2H3,(H,12,14,15).
What are the key properties of 2-methyl-N-(2-methyl-4-pyridinyl)-1,3-thiazole-4-carboxamide?
2-methyl-N-(2-methyl-4-pyridinyl)-1,3-thiazole-4-carboxamide has a molecular weight of 233.30 g/mol, XLogP of 2.41, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(2-methyl-4-pyridinyl)-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 110465342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).