4-fluoro-3-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide

C12H11FN2OS — CID 63212388

IUPAC4-fluoro-3-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide
SMILESCc1cnc(NC(=O)c2ccc(F)c(C)c2)s1
InChIInChI=1S/C12H11FN2OS/c1-7-5-9(3-4-10(7)13)11(16)15-12-14-6-8(2)17-12/h3-6H,1-2H3,(H,14,15,16)
InChIKeyAVZZBXNNSXQQJG-UHFFFAOYSA-N
MW250.30 g/mol
LogP3.15
Rot. Bonds2

About 4-fluoro-3-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide

4-fluoro-3-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide (PubChem CID 63212388) has the molecular formula C12H11FN2OS and a molecular weight of 250.30 g/mol. Its IUPAC name is 4-fluoro-3-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide.

Molecular Properties

Compound Name4-fluoro-3-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide
PubChem CID63212388
Molecular FormulaC12H11FN2OS
Molecular Weight250.30 g/mol
Exact Mass250.06
IUPAC Name4-fluoro-3-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide
SMILESCc1cnc(NC(=O)c2ccc(F)c(C)c2)s1
InChIInChI=1S/C12H11FN2OS/c1-7-5-9(3-4-10(7)13)11(16)15-12-14-6-8(2)17-12/h3-6H,1-2H3,(H,14,15,16)
InChIKeyAVZZBXNNSXQQJG-UHFFFAOYSA-N
XLogP3.15
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-acetamido-4-fluoro-N-(5-methyl-1,3-thiazol-2-yl)benzamide
CID 47366046
4-bromo-3-fluoro-N-(5-methyl-1,3-thiazol-2-yl)benzamide
CID 47421860
4-hydrazinyl-3-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide
CID 63211746
4-(ethylamino)-3-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide
CID 63210150
3,4-dimethoxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide
CID 2109069
3-iodo-N-(5-methyl-1,3-thiazol-2-yl)benzamide
CID 2116508
3-methyl-N-(5-methyl-1,3-thiazol-2-yl)-4-(propylamino)benzamide
CID 63210151
2-fluoro-4-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide
CID 79770175
6-bromo-N-(5-methyl-1,3-thiazol-2-yl)pyridine-3-carboxamide
CID 66463454
4-fluoro-3-methyl-N-(5-methyl-3-pyridinyl)benzamide
CID 103738924
4-(ethylamino)-N-(5-methyl-1,3-thiazol-2-yl)benzamide
CID 62165674
N-(5-bromo-4-methyl-2-pyridinyl)-4-fluoro-3-methylbenzamide
CID 79733912

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-3-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide?
The IUPAC name of 4-fluoro-3-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide (CID 63212388) is 4-fluoro-3-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide.
What is the SMILES notation for 4-fluoro-3-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide?
The canonical SMILES for 4-fluoro-3-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide is Cc1cnc(NC(=O)c2ccc(F)c(C)c2)s1.
What is the InChIKey of 4-fluoro-3-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide?
The InChIKey is AVZZBXNNSXQQJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11FN2OS/c1-7-5-9(3-4-10(7)13)11(16)15-12-14-6-8(2)17-12/h3-6H,1-2H3,(H,14,15,16).
What are the key properties of 4-fluoro-3-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide?
4-fluoro-3-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide has a molecular weight of 250.30 g/mol, XLogP of 3.15, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-3-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide is sourced from PubChem (CID 63212388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).