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

C9H10N4OS — CID 110474080

IUPAC2-methyl-N-(1-methylimidazol-2-yl)-1,3-thiazole-4-carboxamide
SMILESCc1nc(C(=O)Nc2nccn2C)cs1
InChIInChI=1S/C9H10N4OS/c1-6-11-7(5-15-6)8(14)12-9-10-3-4-13(9)2/h3-5H,1-2H3,(H,10,12,14)
InChIKeyRPOWOECGEQKZTF-UHFFFAOYSA-N
MW222.27 g/mol
LogP1.44
Rot. Bonds2

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

2-methyl-N-(1-methylimidazol-2-yl)-1,3-thiazole-4-carboxamide (PubChem CID 110474080) has the molecular formula C9H10N4OS and a molecular weight of 222.27 g/mol. Its IUPAC name is 2-methyl-N-(1-methylimidazol-2-yl)-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound Name2-methyl-N-(1-methylimidazol-2-yl)-1,3-thiazole-4-carboxamide
PubChem CID110474080
Molecular FormulaC9H10N4OS
Molecular Weight222.27 g/mol
Exact Mass222.06
IUPAC Name2-methyl-N-(1-methylimidazol-2-yl)-1,3-thiazole-4-carboxamide
SMILESCc1nc(C(=O)Nc2nccn2C)cs1
InChIInChI=1S/C9H10N4OS/c1-6-11-7(5-15-6)8(14)12-9-10-3-4-13(9)2/h3-5H,1-2H3,(H,10,12,14)
InChIKeyRPOWOECGEQKZTF-UHFFFAOYSA-N
XLogP1.44
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.27
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(1-methylimidazol-2-yl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide
CID 110473002
2-tert-butyl-N-(4-methyl-3-oxopyrazin-2-yl)-1,3-thiazole-4-carboxamide
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4-hydroxy-3,5-dimethyl-N-(1-methylimidazol-2-yl)benzamide
CID 21109027
N-(1-methylimidazol-2-yl)-6-(1,2,4-triazol-4-yl)pyridine-2-carboxamide
CID 134707369
2-methyl-N-(2-methyl-4-pyridinyl)-1,3-thiazole-4-carboxamide
CID 110465342
2-methyl-N-(6-methyl-2-pyridinyl)-1,3-thiazole-4-carboxamide
CID 47445423
N,2-dimethyl-1,3-thiazole-4-carboxamide;methanol
CID 90101890
2-methyl-N-[(1-methylpyrrol-2-yl)methyl]-1,3-thiazole-4-carboxamide
CID 110474082
2-methyl-N-(1-methylpiperidin-4-yl)-1,3-thiazole-4-carboxamide
CID 110465347
2-methyl-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)-1,3-thiazole-4-carboxamide
CID 47443739
2-methyl-N-[2-(triazol-1-yl)ethyl]-1,3-thiazole-4-carboxamide
CID 50981357
N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-2-methyl-1,3-thiazole-4-carboxamide
CID 47444190

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(1-methylimidazol-2-yl)-1,3-thiazole-4-carboxamide?
The IUPAC name of 2-methyl-N-(1-methylimidazol-2-yl)-1,3-thiazole-4-carboxamide (CID 110474080) is 2-methyl-N-(1-methylimidazol-2-yl)-1,3-thiazole-4-carboxamide.
What is the SMILES notation for 2-methyl-N-(1-methylimidazol-2-yl)-1,3-thiazole-4-carboxamide?
The canonical SMILES for 2-methyl-N-(1-methylimidazol-2-yl)-1,3-thiazole-4-carboxamide is Cc1nc(C(=O)Nc2nccn2C)cs1.
What is the InChIKey of 2-methyl-N-(1-methylimidazol-2-yl)-1,3-thiazole-4-carboxamide?
The InChIKey is RPOWOECGEQKZTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N4OS/c1-6-11-7(5-15-6)8(14)12-9-10-3-4-13(9)2/h3-5H,1-2H3,(H,10,12,14).
What are the key properties of 2-methyl-N-(1-methylimidazol-2-yl)-1,3-thiazole-4-carboxamide?
2-methyl-N-(1-methylimidazol-2-yl)-1,3-thiazole-4-carboxamide has a molecular weight of 222.27 g/mol, XLogP of 1.44, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(1-methylimidazol-2-yl)-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 110474080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).