5-chloro-2-fluoro-N-methyl-N-(thiophen-3-ylmethyl)benzamide

C13H11ClFNOS — CID 60674455

IUPAC5-chloro-2-fluoro-N-methyl-N-(thiophen-3-ylmethyl)benzamide
SMILESCN(Cc1ccsc1)C(=O)c1cc(Cl)ccc1F
InChIInChI=1S/C13H11ClFNOS/c1-16(7-9-4-5-18-8-9)13(17)11-6-10(14)2-3-12(11)15/h2-6,8H,7H2,1H3
InChIKeyNVFDXTZFSSQBQA-UHFFFAOYSA-N
MW283.76 g/mol
LogP3.81
Rot. Bonds3

About 5-chloro-2-fluoro-N-methyl-N-(thiophen-3-ylmethyl)benzamide

5-chloro-2-fluoro-N-methyl-N-(thiophen-3-ylmethyl)benzamide (PubChem CID 60674455) has the molecular formula C13H11ClFNOS and a molecular weight of 283.76 g/mol. Its IUPAC name is 5-chloro-2-fluoro-N-methyl-N-(thiophen-3-ylmethyl)benzamide.

Molecular Properties

Compound Name5-chloro-2-fluoro-N-methyl-N-(thiophen-3-ylmethyl)benzamide
PubChem CID60674455
Molecular FormulaC13H11ClFNOS
Molecular Weight283.76 g/mol
Exact Mass283.02
IUPAC Name5-chloro-2-fluoro-N-methyl-N-(thiophen-3-ylmethyl)benzamide
SMILESCN(Cc1ccsc1)C(=O)c1cc(Cl)ccc1F
InChIInChI=1S/C13H11ClFNOS/c1-16(7-9-4-5-18-8-9)13(17)11-6-10(14)2-3-12(11)15/h2-6,8H,7H2,1H3
InChIKeyNVFDXTZFSSQBQA-UHFFFAOYSA-N
XLogP3.81
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.76
LogP ≤ 53.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-chloro-2-fluoro-N-[(3-fluorophenyl)methyl]-N-methylbenzamide
CID 60674642
5-chloro-2-fluoro-N-methyl-N-(pyridin-4-ylmethyl)benzamide
CID 53016447
2-fluoro-4-methoxy-N-methyl-N-(thiophen-3-ylmethyl)benzamide
CID 113218973
[2-[methyl(thiophen-3-ylmethyl)amino]-2-oxoethyl] 2,5-dichlorobenzoate
CID 55397033
2,6-dichloro-N-methyl-N-(thiophen-3-ylmethyl)pyridine-3-carboxamide
CID 113227301
2,6-dichloro-N-methyl-N-(thiophen-3-ylmethyl)pyridine-4-carboxamide
CID 43396649
4-amino-3-fluoro-N-methyl-N-(thiophen-3-ylmethyl)benzamide
CID 62678324
2-chloro-N-methyl-5-nitro-N-(thiophen-3-ylmethyl)benzamide
CID 43396643
2-(4-chlorophenyl)-N-methyl-N-(thiophen-3-ylmethyl)acetamide
CID 110868986
5,6-dichloro-N-methyl-N-(thiophen-3-ylmethyl)pyridine-3-carboxamide
CID 43396646
5-amino-4-fluoro-N-methyl-2-nitro-N-(thiophen-3-ylmethyl)benzamide
CID 62155138
N-[(3,4-dichlorophenyl)methyl]-2-fluoro-N,5-dimethylbenzamide
CID 62510958

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-fluoro-N-methyl-N-(thiophen-3-ylmethyl)benzamide?
The IUPAC name of 5-chloro-2-fluoro-N-methyl-N-(thiophen-3-ylmethyl)benzamide (CID 60674455) is 5-chloro-2-fluoro-N-methyl-N-(thiophen-3-ylmethyl)benzamide.
What is the SMILES notation for 5-chloro-2-fluoro-N-methyl-N-(thiophen-3-ylmethyl)benzamide?
The canonical SMILES for 5-chloro-2-fluoro-N-methyl-N-(thiophen-3-ylmethyl)benzamide is CN(Cc1ccsc1)C(=O)c1cc(Cl)ccc1F.
What is the InChIKey of 5-chloro-2-fluoro-N-methyl-N-(thiophen-3-ylmethyl)benzamide?
The InChIKey is NVFDXTZFSSQBQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11ClFNOS/c1-16(7-9-4-5-18-8-9)13(17)11-6-10(14)2-3-12(11)15/h2-6,8H,7H2,1H3.
What are the key properties of 5-chloro-2-fluoro-N-methyl-N-(thiophen-3-ylmethyl)benzamide?
5-chloro-2-fluoro-N-methyl-N-(thiophen-3-ylmethyl)benzamide has a molecular weight of 283.76 g/mol, XLogP of 3.81, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-fluoro-N-methyl-N-(thiophen-3-ylmethyl)benzamide is sourced from PubChem (CID 60674455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).