2,3-dichloro-N-(3-fluorophenyl)benzamide

C13H8Cl2FNO — CID 802685

IUPAC2,3-dichloro-N-(3-fluorophenyl)benzamide
SMILESO=C(Nc1cccc(F)c1)c1cccc(Cl)c1Cl
InChIInChI=1S/C13H8Cl2FNO/c14-11-6-2-5-10(12(11)15)13(18)17-9-4-1-3-8(16)7-9/h1-7H,(H,17,18)
InChIKeyPYAFOEIFRFEGQE-UHFFFAOYSA-N
MW284.12 g/mol
LogP4.38
Rot. Bonds2

About 2,3-dichloro-N-(3-fluorophenyl)benzamide

2,3-dichloro-N-(3-fluorophenyl)benzamide (PubChem CID 802685) has the molecular formula C13H8Cl2FNO and a molecular weight of 284.12 g/mol. Its IUPAC name is 2,3-dichloro-N-(3-fluorophenyl)benzamide.

Molecular Properties

Compound Name2,3-dichloro-N-(3-fluorophenyl)benzamide
PubChem CID802685
Molecular FormulaC13H8Cl2FNO
Molecular Weight284.12 g/mol
Exact Mass283.00
IUPAC Name2,3-dichloro-N-(3-fluorophenyl)benzamide
SMILESO=C(Nc1cccc(F)c1)c1cccc(Cl)c1Cl
InChIInChI=1S/C13H8Cl2FNO/c14-11-6-2-5-10(12(11)15)13(18)17-9-4-1-3-8(16)7-9/h1-7H,(H,17,18)
InChIKeyPYAFOEIFRFEGQE-UHFFFAOYSA-N
XLogP4.38
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.12
LogP ≤ 54.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,3-dichloro-N-(3-fluorophenyl)benzamide?
The IUPAC name of 2,3-dichloro-N-(3-fluorophenyl)benzamide (CID 802685) is 2,3-dichloro-N-(3-fluorophenyl)benzamide.
What is the SMILES notation for 2,3-dichloro-N-(3-fluorophenyl)benzamide?
The canonical SMILES for 2,3-dichloro-N-(3-fluorophenyl)benzamide is O=C(Nc1cccc(F)c1)c1cccc(Cl)c1Cl.
What is the InChIKey of 2,3-dichloro-N-(3-fluorophenyl)benzamide?
The InChIKey is PYAFOEIFRFEGQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8Cl2FNO/c14-11-6-2-5-10(12(11)15)13(18)17-9-4-1-3-8(16)7-9/h1-7H,(H,17,18).
What are the key properties of 2,3-dichloro-N-(3-fluorophenyl)benzamide?
2,3-dichloro-N-(3-fluorophenyl)benzamide has a molecular weight of 284.12 g/mol, XLogP of 4.38, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dichloro-N-(3-fluorophenyl)benzamide is sourced from PubChem (CID 802685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).