2-chloro-4-fluoro-N-(3-methoxyphenyl)benzamide

C14H11ClFNO2 — CID 6465515

IUPAC2-chloro-4-fluoro-N-(3-methoxyphenyl)benzamide
SMILESCOc1cccc(NC(=O)c2ccc(F)cc2Cl)c1
InChIInChI=1S/C14H11ClFNO2/c1-19-11-4-2-3-10(8-11)17-14(18)12-6-5-9(16)7-13(12)15/h2-8H,1H3,(H,17,18)
InChIKeyLBQOOXBRXBPWPA-UHFFFAOYSA-N
MW279.70 g/mol
LogP3.74
Rot. Bonds3

About 2-chloro-4-fluoro-N-(3-methoxyphenyl)benzamide

2-chloro-4-fluoro-N-(3-methoxyphenyl)benzamide (PubChem CID 6465515) has the molecular formula C14H11ClFNO2 and a molecular weight of 279.70 g/mol. Its IUPAC name is 2-chloro-4-fluoro-N-(3-methoxyphenyl)benzamide.

Molecular Properties

Compound Name2-chloro-4-fluoro-N-(3-methoxyphenyl)benzamide
PubChem CID6465515
Molecular FormulaC14H11ClFNO2
Molecular Weight279.70 g/mol
Exact Mass279.05
IUPAC Name2-chloro-4-fluoro-N-(3-methoxyphenyl)benzamide
SMILESCOc1cccc(NC(=O)c2ccc(F)cc2Cl)c1
InChIInChI=1S/C14H11ClFNO2/c1-19-11-4-2-3-10(8-11)17-14(18)12-6-5-9(16)7-13(12)15/h2-8H,1H3,(H,17,18)
InChIKeyLBQOOXBRXBPWPA-UHFFFAOYSA-N
XLogP3.74
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.70
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-4-fluoro-N-(3-methoxyphenyl)benzamide?
The IUPAC name of 2-chloro-4-fluoro-N-(3-methoxyphenyl)benzamide (CID 6465515) is 2-chloro-4-fluoro-N-(3-methoxyphenyl)benzamide.
What is the SMILES notation for 2-chloro-4-fluoro-N-(3-methoxyphenyl)benzamide?
The canonical SMILES for 2-chloro-4-fluoro-N-(3-methoxyphenyl)benzamide is COc1cccc(NC(=O)c2ccc(F)cc2Cl)c1.
What is the InChIKey of 2-chloro-4-fluoro-N-(3-methoxyphenyl)benzamide?
The InChIKey is LBQOOXBRXBPWPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11ClFNO2/c1-19-11-4-2-3-10(8-11)17-14(18)12-6-5-9(16)7-13(12)15/h2-8H,1H3,(H,17,18).
What are the key properties of 2-chloro-4-fluoro-N-(3-methoxyphenyl)benzamide?
2-chloro-4-fluoro-N-(3-methoxyphenyl)benzamide has a molecular weight of 279.70 g/mol, XLogP of 3.74, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4-fluoro-N-(3-methoxyphenyl)benzamide is sourced from PubChem (CID 6465515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).