N-[2-(5-methyl-1H-imidazol-2-yl)phenyl]-1,2-thiazole-4-carboxamide

C14H12N4OS — CID 166366294

IUPACN-[2-(5-methyl-1H-imidazol-2-yl)phenyl]-1,2-thiazole-4-carboxamide
SMILESCc1cnc(-c2ccccc2NC(=O)c2cnsc2)[nH]1
InChIInChI=1S/C14H12N4OS/c1-9-6-15-13(17-9)11-4-2-3-5-12(11)18-14(19)10-7-16-20-8-10/h2-8H,1H3,(H,15,17)(H,18,19)
InChIKeyAQWULAVDTRLKPU-UHFFFAOYSA-N
MW284.34 g/mol
LogP3.09
Rot. Bonds3

About N-[2-(5-methyl-1H-imidazol-2-yl)phenyl]-1,2-thiazole-4-carboxamide

N-[2-(5-methyl-1H-imidazol-2-yl)phenyl]-1,2-thiazole-4-carboxamide (PubChem CID 166366294) has the molecular formula C14H12N4OS and a molecular weight of 284.34 g/mol. Its IUPAC name is N-[2-(5-methyl-1H-imidazol-2-yl)phenyl]-1,2-thiazole-4-carboxamide.

Molecular Properties

Compound NameN-[2-(5-methyl-1H-imidazol-2-yl)phenyl]-1,2-thiazole-4-carboxamide
PubChem CID166366294
Molecular FormulaC14H12N4OS
Molecular Weight284.34 g/mol
Exact Mass284.07
IUPAC NameN-[2-(5-methyl-1H-imidazol-2-yl)phenyl]-1,2-thiazole-4-carboxamide
SMILESCc1cnc(-c2ccccc2NC(=O)c2cnsc2)[nH]1
InChIInChI=1S/C14H12N4OS/c1-9-6-15-13(17-9)11-4-2-3-5-12(11)18-14(19)10-7-16-20-8-10/h2-8H,1H3,(H,15,17)(H,18,19)
InChIKeyAQWULAVDTRLKPU-UHFFFAOYSA-N
XLogP3.09
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.34
LogP ≤ 53.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-bromo-N-[2-(5-methyl-1H-imidazol-2-yl)phenyl]furan-2-carboxamide
CID 167918709
4-fluoro-N-[2-(5-methyl-1H-imidazol-2-yl)phenyl]-1H-pyrrole-2-carboxamide
CID 167790330
1-methyl-N-[2-(5-methyl-1H-imidazol-2-yl)phenyl]-4-sulfamoylpyrrole-2-carboxamide
CID 166186064
3-(3,5-dimethyl-1H-pyrazol-4-yl)-2-methyl-N-[2-(5-methyl-1H-imidazol-2-yl)phenyl]propanamide
CID 166227113
2-(2,3-difluorophenyl)-N-[2-(5-methyl-1H-imidazol-2-yl)phenyl]cyclopropane-1-carboxamide
CID 71847061
5-bromo-N-[2-(5-methyl-1H-1,2,4-triazol-3-yl)phenyl]thiophene-3-carboxamide
CID 60956125
1,2-thiazole-4-carbohydrazide
CID 57357253
3,4-dimethyl-N-[2-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide
CID 90626115
N-[2-(2-methyl-1,3-thiazol-4-yl)phenyl]pyridine-2-carboxamide
CID 90626104
5-methyl-N-quinolin-8-ylthiophene-3-carboxamide
CID 166451949
2-benzamido-N-(5-methyl-1,3-thiazol-2-yl)benzamide
CID 35935216
3,4-dimethoxy-N-[2-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide
CID 90626060

Frequently Asked Questions

What is the IUPAC name of N-[2-(5-methyl-1H-imidazol-2-yl)phenyl]-1,2-thiazole-4-carboxamide?
The IUPAC name of N-[2-(5-methyl-1H-imidazol-2-yl)phenyl]-1,2-thiazole-4-carboxamide (CID 166366294) is N-[2-(5-methyl-1H-imidazol-2-yl)phenyl]-1,2-thiazole-4-carboxamide.
What is the SMILES notation for N-[2-(5-methyl-1H-imidazol-2-yl)phenyl]-1,2-thiazole-4-carboxamide?
The canonical SMILES for N-[2-(5-methyl-1H-imidazol-2-yl)phenyl]-1,2-thiazole-4-carboxamide is Cc1cnc(-c2ccccc2NC(=O)c2cnsc2)[nH]1.
What is the InChIKey of N-[2-(5-methyl-1H-imidazol-2-yl)phenyl]-1,2-thiazole-4-carboxamide?
The InChIKey is AQWULAVDTRLKPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N4OS/c1-9-6-15-13(17-9)11-4-2-3-5-12(11)18-14(19)10-7-16-20-8-10/h2-8H,1H3,(H,15,17)(H,18,19).
What are the key properties of N-[2-(5-methyl-1H-imidazol-2-yl)phenyl]-1,2-thiazole-4-carboxamide?
N-[2-(5-methyl-1H-imidazol-2-yl)phenyl]-1,2-thiazole-4-carboxamide has a molecular weight of 284.34 g/mol, XLogP of 3.09, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(5-methyl-1H-imidazol-2-yl)phenyl]-1,2-thiazole-4-carboxamide is sourced from PubChem (CID 166366294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).