2-fluoro-N-methyl-N-(1,3-thiazol-2-ylmethyl)benzamide

C12H11FN2OS — CID 110715660

IUPAC2-fluoro-N-methyl-N-(1,3-thiazol-2-ylmethyl)benzamide
SMILESCN(Cc1nccs1)C(=O)c1ccccc1F
InChIInChI=1S/C12H11FN2OS/c1-15(8-11-14-6-7-17-11)12(16)9-4-2-3-5-10(9)13/h2-7H,8H2,1H3
InChIKeyITZRHXUNCWFQNT-UHFFFAOYSA-N
MW250.30 g/mol
LogP2.55
Rot. Bonds3

About 2-fluoro-N-methyl-N-(1,3-thiazol-2-ylmethyl)benzamide

2-fluoro-N-methyl-N-(1,3-thiazol-2-ylmethyl)benzamide (PubChem CID 110715660) has the molecular formula C12H11FN2OS and a molecular weight of 250.30 g/mol. Its IUPAC name is 2-fluoro-N-methyl-N-(1,3-thiazol-2-ylmethyl)benzamide.

Molecular Properties

Compound Name2-fluoro-N-methyl-N-(1,3-thiazol-2-ylmethyl)benzamide
PubChem CID110715660
Molecular FormulaC12H11FN2OS
Molecular Weight250.30 g/mol
Exact Mass250.06
IUPAC Name2-fluoro-N-methyl-N-(1,3-thiazol-2-ylmethyl)benzamide
SMILESCN(Cc1nccs1)C(=O)c1ccccc1F
InChIInChI=1S/C12H11FN2OS/c1-15(8-11-14-6-7-17-11)12(16)9-4-2-3-5-10(9)13/h2-7H,8H2,1H3
InChIKeyITZRHXUNCWFQNT-UHFFFAOYSA-N
XLogP2.55
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 52.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-fluoro-N-methyl-N-(2-thiophen-2-ylethyl)benzamide
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N-[(2-fluorophenyl)methyl]-N,2,5-trimethyl-1-(1,3-thiazol-2-yl)pyrrole-3-carboxamide
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2-fluoro-N-[2-(1,3-thiazol-2-yl)propyl]benzamide
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2-methoxy-N,6-dimethyl-N-(1,3-thiazol-2-ylmethyl)benzamide
CID 131946527
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2-fluoro-N-[(4-methoxyphenyl)methyl]-N-methylbenzamide
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N-methyl-N-(1,3-thiazol-2-ylmethyl)prop-2-ynamide
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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-methyl-N-(1,3-thiazol-2-ylmethyl)benzamide?
The IUPAC name of 2-fluoro-N-methyl-N-(1,3-thiazol-2-ylmethyl)benzamide (CID 110715660) is 2-fluoro-N-methyl-N-(1,3-thiazol-2-ylmethyl)benzamide.
What is the SMILES notation for 2-fluoro-N-methyl-N-(1,3-thiazol-2-ylmethyl)benzamide?
The canonical SMILES for 2-fluoro-N-methyl-N-(1,3-thiazol-2-ylmethyl)benzamide is CN(Cc1nccs1)C(=O)c1ccccc1F.
What is the InChIKey of 2-fluoro-N-methyl-N-(1,3-thiazol-2-ylmethyl)benzamide?
The InChIKey is ITZRHXUNCWFQNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11FN2OS/c1-15(8-11-14-6-7-17-11)12(16)9-4-2-3-5-10(9)13/h2-7H,8H2,1H3.
What are the key properties of 2-fluoro-N-methyl-N-(1,3-thiazol-2-ylmethyl)benzamide?
2-fluoro-N-methyl-N-(1,3-thiazol-2-ylmethyl)benzamide has a molecular weight of 250.30 g/mol, XLogP of 2.55, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-methyl-N-(1,3-thiazol-2-ylmethyl)benzamide is sourced from PubChem (CID 110715660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).