2-amino-N-(5-fluoro-2-methylphenyl)-1,3-thiazole-4-carboxamide

C11H10FN3OS — CID 55116155

IUPAC2-amino-N-(5-fluoro-2-methylphenyl)-1,3-thiazole-4-carboxamide
SMILESCc1ccc(F)cc1NC(=O)c1csc(N)n1
InChIInChI=1S/C11H10FN3OS/c1-6-2-3-7(12)4-8(6)14-10(16)9-5-17-11(13)15-9/h2-5H,1H3,(H2,13,15)(H,14,16)
InChIKeyYFBNLKGLYJWJCU-UHFFFAOYSA-N
MW251.29 g/mol
LogP2.43
Rot. Bonds2

About 2-amino-N-(5-fluoro-2-methylphenyl)-1,3-thiazole-4-carboxamide

2-amino-N-(5-fluoro-2-methylphenyl)-1,3-thiazole-4-carboxamide (PubChem CID 55116155) has the molecular formula C11H10FN3OS and a molecular weight of 251.29 g/mol. Its IUPAC name is 2-amino-N-(5-fluoro-2-methylphenyl)-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound Name2-amino-N-(5-fluoro-2-methylphenyl)-1,3-thiazole-4-carboxamide
PubChem CID55116155
Molecular FormulaC11H10FN3OS
Molecular Weight251.29 g/mol
Exact Mass251.05
IUPAC Name2-amino-N-(5-fluoro-2-methylphenyl)-1,3-thiazole-4-carboxamide
SMILESCc1ccc(F)cc1NC(=O)c1csc(N)n1
InChIInChI=1S/C11H10FN3OS/c1-6-2-3-7(12)4-8(6)14-10(16)9-5-17-11(13)15-9/h2-5H,1H3,(H2,13,15)(H,14,16)
InChIKeyYFBNLKGLYJWJCU-UHFFFAOYSA-N
XLogP2.43
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.29
LogP ≤ 52.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-(5-chloro-2-methylphenyl)-1,3-thiazole-4-carboxamide
CID 55116247
2-amino-N-[2-methyl-5-(trifluoromethyl)phenyl]-1,3-thiazole-4-carboxamide
CID 66475257
4-amino-N-(5-fluoro-2-methylphenyl)pyridine-2-carboxamide
CID 62155744
2-amino-N-[5-(ethylcarbamoyl)-2-methylphenyl]-1,3-thiazole-4-carboxamide
CID 62787357
N-(5-fluoro-2-methylphenyl)-2-thiophen-2-yl-1,3-thiazole-4-carboxamide
CID 9045051
2-amino-N-(4-fluoro-2-nitrophenyl)-1,3-thiazole-4-carboxamide
CID 62787167
2-amino-N-(4-fluoro-3-methylphenyl)-1,3-thiazole-4-carboxamide
CID 55119460
2-amino-N-(4-chloro-2-fluorophenyl)-1,3-thiazole-4-carboxamide
CID 62788574
2-amino-N-(2,5-dichloro-4-methylphenyl)-1,3-thiazole-4-carboxamide
CID 113445874
N-(5-fluoro-2-methylphenyl)-6-hydrazinylpyridine-2-carboxamide
CID 62249406
methyl 3-[(2-amino-1,3-thiazole-4-carbonyl)amino]-4-fluorobenzoate
CID 62786661
2-amino-N-[4-(ethylcarbamoyl)-2-methylphenyl]-1,3-thiazole-4-carboxamide
CID 62787362

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(5-fluoro-2-methylphenyl)-1,3-thiazole-4-carboxamide?
The IUPAC name of 2-amino-N-(5-fluoro-2-methylphenyl)-1,3-thiazole-4-carboxamide (CID 55116155) is 2-amino-N-(5-fluoro-2-methylphenyl)-1,3-thiazole-4-carboxamide.
What is the SMILES notation for 2-amino-N-(5-fluoro-2-methylphenyl)-1,3-thiazole-4-carboxamide?
The canonical SMILES for 2-amino-N-(5-fluoro-2-methylphenyl)-1,3-thiazole-4-carboxamide is Cc1ccc(F)cc1NC(=O)c1csc(N)n1.
What is the InChIKey of 2-amino-N-(5-fluoro-2-methylphenyl)-1,3-thiazole-4-carboxamide?
The InChIKey is YFBNLKGLYJWJCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10FN3OS/c1-6-2-3-7(12)4-8(6)14-10(16)9-5-17-11(13)15-9/h2-5H,1H3,(H2,13,15)(H,14,16).
What are the key properties of 2-amino-N-(5-fluoro-2-methylphenyl)-1,3-thiazole-4-carboxamide?
2-amino-N-(5-fluoro-2-methylphenyl)-1,3-thiazole-4-carboxamide has a molecular weight of 251.29 g/mol, XLogP of 2.43, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(5-fluoro-2-methylphenyl)-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 55116155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).