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

C12H11FN2OS — CID 79770175

IUPAC2-fluoro-4-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide
SMILESCc1ccc(C(=O)Nc2ncc(C)s2)c(F)c1
InChIInChI=1S/C12H11FN2OS/c1-7-3-4-9(10(13)5-7)11(16)15-12-14-6-8(2)17-12/h3-6H,1-2H3,(H,14,15,16)
InChIKeyFUSBEILNZBDSCS-UHFFFAOYSA-N
MW250.30 g/mol
LogP3.15
Rot. Bonds2

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

2-fluoro-4-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide (PubChem CID 79770175) has the molecular formula C12H11FN2OS and a molecular weight of 250.30 g/mol. Its IUPAC name is 2-fluoro-4-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide.

Molecular Properties

Compound Name2-fluoro-4-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide
PubChem CID79770175
Molecular FormulaC12H11FN2OS
Molecular Weight250.30 g/mol
Exact Mass250.06
IUPAC Name2-fluoro-4-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide
SMILESCc1ccc(C(=O)Nc2ncc(C)s2)c(F)c1
InChIInChI=1S/C12H11FN2OS/c1-7-3-4-9(10(13)5-7)11(16)15-12-14-6-8(2)17-12/h3-6H,1-2H3,(H,14,15,16)
InChIKeyFUSBEILNZBDSCS-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

4-fluoro-2-hydroxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide
CID 103829649
4-(3-aminoprop-1-ynyl)-2-fluoro-N-(5-methyl-1,3-thiazol-2-yl)benzamide
CID 60821186
2-(methanesulfonamido)-5-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide
CID 51097784
N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-fluoro-4-methylbenzamide
CID 79769818
2-fluoro-4-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)benzamide
CID 79765196
4-fluoro-3-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide
CID 63212388
4-bromo-2-hydroxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide
CID 47435879
5-amino-2-methoxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide
CID 61092626
2-hydroxy-3-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide;2-hydroxy-4-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide;2-hydroxy-5-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide;tris(2-hydroxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide)
CID 167706906
N-(5-chloro-2-pyridinyl)-2-fluoro-4-methylbenzamide
CID 79770805
4-bromo-3-fluoro-N-(5-methyl-1,3-thiazol-2-yl)benzamide
CID 47421860
3-[4-fluoro-3-[(5-methyl-1,3-thiazol-2-yl)carbamoyl]phenyl]prop-2-enoic acid
CID 76906310

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-4-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide?
The IUPAC name of 2-fluoro-4-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide (CID 79770175) is 2-fluoro-4-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide.
What is the SMILES notation for 2-fluoro-4-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide?
The canonical SMILES for 2-fluoro-4-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide is Cc1ccc(C(=O)Nc2ncc(C)s2)c(F)c1.
What is the InChIKey of 2-fluoro-4-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide?
The InChIKey is FUSBEILNZBDSCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11FN2OS/c1-7-3-4-9(10(13)5-7)11(16)15-12-14-6-8(2)17-12/h3-6H,1-2H3,(H,14,15,16).
What are the key properties of 2-fluoro-4-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide?
2-fluoro-4-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 2-fluoro-4-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide is sourced from PubChem (CID 79770175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).