5-chloro-N-(2-chloro-6-methylphenyl)-2-fluorobenzamide

C14H10Cl2FNO — CID 66254946

IUPAC5-chloro-N-(2-chloro-6-methylphenyl)-2-fluorobenzamide
SMILESCc1cccc(Cl)c1NC(=O)c1cc(Cl)ccc1F
InChIInChI=1S/C14H10Cl2FNO/c1-8-3-2-4-11(16)13(8)18-14(19)10-7-9(15)5-6-12(10)17/h2-7H,1H3,(H,18,19)
InChIKeyIPANBLUCVIFZDC-UHFFFAOYSA-N
MW298.14 g/mol
LogP4.69
Rot. Bonds2

About 5-chloro-N-(2-chloro-6-methylphenyl)-2-fluorobenzamide

5-chloro-N-(2-chloro-6-methylphenyl)-2-fluorobenzamide (PubChem CID 66254946) has the molecular formula C14H10Cl2FNO and a molecular weight of 298.14 g/mol. Its IUPAC name is 5-chloro-N-(2-chloro-6-methylphenyl)-2-fluorobenzamide.

Molecular Properties

Compound Name5-chloro-N-(2-chloro-6-methylphenyl)-2-fluorobenzamide
PubChem CID66254946
Molecular FormulaC14H10Cl2FNO
Molecular Weight298.14 g/mol
Exact Mass297.01
IUPAC Name5-chloro-N-(2-chloro-6-methylphenyl)-2-fluorobenzamide
SMILESCc1cccc(Cl)c1NC(=O)c1cc(Cl)ccc1F
InChIInChI=1S/C14H10Cl2FNO/c1-8-3-2-4-11(16)13(8)18-14(19)10-7-9(15)5-6-12(10)17/h2-7H,1H3,(H,18,19)
InChIKeyIPANBLUCVIFZDC-UHFFFAOYSA-N
XLogP4.69
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.14
LogP ≤ 54.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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N-(2-chloro-6-methylphenyl)-4-hydroxy-2-methylbenzamide
CID 103865613
N-(2-chloro-6-methylphenyl)-3,5-difluoro-4-hydrazinylbenzamide
CID 66255840
2,6-dichloro-N-(2-chloro-6-methylphenyl)benzamide
CID 4548334
N-(2-chloro-6-methylphenyl)-2-hydroxy-4-methylbenzamide
CID 66255531
N-(2,6-dimethylphenyl)-2-fluorobenzamide
CID 4097270
2-fluoro-N-(2-fluoro-6-methylphenyl)benzamide
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2-[(2-fluoro-5-methylbenzoyl)amino]-3-methylbenzoic acid
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2,5-dichloro-N-[2-methyl-6-(pyrrolidine-1-carbonyl)phenyl]benzamide
CID 55643315

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(2-chloro-6-methylphenyl)-2-fluorobenzamide?
The IUPAC name of 5-chloro-N-(2-chloro-6-methylphenyl)-2-fluorobenzamide (CID 66254946) is 5-chloro-N-(2-chloro-6-methylphenyl)-2-fluorobenzamide.
What is the SMILES notation for 5-chloro-N-(2-chloro-6-methylphenyl)-2-fluorobenzamide?
The canonical SMILES for 5-chloro-N-(2-chloro-6-methylphenyl)-2-fluorobenzamide is Cc1cccc(Cl)c1NC(=O)c1cc(Cl)ccc1F.
What is the InChIKey of 5-chloro-N-(2-chloro-6-methylphenyl)-2-fluorobenzamide?
The InChIKey is IPANBLUCVIFZDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10Cl2FNO/c1-8-3-2-4-11(16)13(8)18-14(19)10-7-9(15)5-6-12(10)17/h2-7H,1H3,(H,18,19).
What are the key properties of 5-chloro-N-(2-chloro-6-methylphenyl)-2-fluorobenzamide?
5-chloro-N-(2-chloro-6-methylphenyl)-2-fluorobenzamide has a molecular weight of 298.14 g/mol, XLogP of 4.69, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(2-chloro-6-methylphenyl)-2-fluorobenzamide is sourced from PubChem (CID 66254946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).