N-(2-chloro-5-fluorophenyl)-2-fluorobenzamide

C13H8ClF2NO — CID 113231148

IUPACN-(2-chloro-5-fluorophenyl)-2-fluorobenzamide
SMILESO=C(Nc1cc(F)ccc1Cl)c1ccccc1F
InChIInChI=1S/C13H8ClF2NO/c14-10-6-5-8(15)7-12(10)17-13(18)9-3-1-2-4-11(9)16/h1-7H,(H,17,18)
InChIKeyYHWQBDBFDPKDGG-UHFFFAOYSA-N
MW267.66 g/mol
LogP3.87
Rot. Bonds2

About N-(2-chloro-5-fluorophenyl)-2-fluorobenzamide

N-(2-chloro-5-fluorophenyl)-2-fluorobenzamide (PubChem CID 113231148) has the molecular formula C13H8ClF2NO and a molecular weight of 267.66 g/mol. Its IUPAC name is N-(2-chloro-5-fluorophenyl)-2-fluorobenzamide.

Molecular Properties

Compound NameN-(2-chloro-5-fluorophenyl)-2-fluorobenzamide
PubChem CID113231148
Molecular FormulaC13H8ClF2NO
Molecular Weight267.66 g/mol
Exact Mass267.03
IUPAC NameN-(2-chloro-5-fluorophenyl)-2-fluorobenzamide
SMILESO=C(Nc1cc(F)ccc1Cl)c1ccccc1F
InChIInChI=1S/C13H8ClF2NO/c14-10-6-5-8(15)7-12(10)17-13(18)9-3-1-2-4-11(9)16/h1-7H,(H,17,18)
InChIKeyYHWQBDBFDPKDGG-UHFFFAOYSA-N
XLogP3.87
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.66
LogP ≤ 53.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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N-[3-[(2-aminoacetyl)amino]-4-chlorophenyl]-2-fluorobenzamide
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1-N,2-N-bis(2,4-difluorophenyl)benzene-1,2-dicarboxamide
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Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-5-fluorophenyl)-2-fluorobenzamide?
The IUPAC name of N-(2-chloro-5-fluorophenyl)-2-fluorobenzamide (CID 113231148) is N-(2-chloro-5-fluorophenyl)-2-fluorobenzamide.
What is the SMILES notation for N-(2-chloro-5-fluorophenyl)-2-fluorobenzamide?
The canonical SMILES for N-(2-chloro-5-fluorophenyl)-2-fluorobenzamide is O=C(Nc1cc(F)ccc1Cl)c1ccccc1F.
What is the InChIKey of N-(2-chloro-5-fluorophenyl)-2-fluorobenzamide?
The InChIKey is YHWQBDBFDPKDGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8ClF2NO/c14-10-6-5-8(15)7-12(10)17-13(18)9-3-1-2-4-11(9)16/h1-7H,(H,17,18).
What are the key properties of N-(2-chloro-5-fluorophenyl)-2-fluorobenzamide?
N-(2-chloro-5-fluorophenyl)-2-fluorobenzamide has a molecular weight of 267.66 g/mol, XLogP of 3.87, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-5-fluorophenyl)-2-fluorobenzamide is sourced from PubChem (CID 113231148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).