3,5-dichloro-4-[(2-fluorophenyl)methoxy]benzamide

C14H10Cl2FNO2 — CID 91682781

IUPAC3,5-dichloro-4-[(2-fluorophenyl)methoxy]benzamide
SMILESNC(=O)c1cc(Cl)c(OCc2ccccc2F)c(Cl)c1
InChIInChI=1S/C14H10Cl2FNO2/c15-10-5-9(14(18)19)6-11(16)13(10)20-7-8-3-1-2-4-12(8)17/h1-6H,7H2,(H2,18,19)
InChIKeyLTIIZMRCHCUVMF-UHFFFAOYSA-N
MW314.14 g/mol
LogP3.81
Rot. Bonds4

About 3,5-dichloro-4-[(2-fluorophenyl)methoxy]benzamide

3,5-dichloro-4-[(2-fluorophenyl)methoxy]benzamide (PubChem CID 91682781) has the molecular formula C14H10Cl2FNO2 and a molecular weight of 314.14 g/mol. Its IUPAC name is 3,5-dichloro-4-[(2-fluorophenyl)methoxy]benzamide.

Molecular Properties

Compound Name3,5-dichloro-4-[(2-fluorophenyl)methoxy]benzamide
PubChem CID91682781
Molecular FormulaC14H10Cl2FNO2
Molecular Weight314.14 g/mol
Exact Mass313.01
IUPAC Name3,5-dichloro-4-[(2-fluorophenyl)methoxy]benzamide
SMILESNC(=O)c1cc(Cl)c(OCc2ccccc2F)c(Cl)c1
InChIInChI=1S/C14H10Cl2FNO2/c15-10-5-9(14(18)19)6-11(16)13(10)20-7-8-3-1-2-4-12(8)17/h1-6H,7H2,(H2,18,19)
InChIKeyLTIIZMRCHCUVMF-UHFFFAOYSA-N
XLogP3.81
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.14
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3,5-dichloro-4-[(2-methylphenyl)methoxy]benzamide
CID 91682780
prop-2-ynyl 3,5-dichloro-4-[(2-fluorophenyl)methoxy]benzoate
CID 91682729
3-chloro-4-[(2-fluorophenyl)methoxy]-5-methoxybenzoic acid
CID 8707053
3-chloro-4-[(2-fluorophenyl)methoxy]-5-methoxybenzenecarbothioamide
CID 20989280
ethyl 3-bromo-5-chloro-4-[(2-fluorophenyl)methoxy]benzoate
CID 91685967
3-chloro-5-ethoxy-4-[(2-fluorophenyl)methoxy]benzoate
CID 8707056
3,5-dibromo-4-[(2-fluorophenyl)methoxy]benzoic acid
CID 8707072
3-chloro-4-[(2-fluorophenyl)methoxy]benzenecarbothioamide
CID 61389088
(2-fluorophenyl)methyl 5,6-dichloropyridine-3-carboxylate
CID 3288046
5-chloro-6-[[4-[(2-fluorophenyl)methoxy]phenyl]methylamino]pyridine-3-carboxamide
CID 133477282
3,5-dibromo-4-[(2-fluorophenyl)methoxy]benzoate
CID 8707071
3,5-dichloro-4-[(4-methylphenyl)methoxy]benzamide
CID 91682782

Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-4-[(2-fluorophenyl)methoxy]benzamide?
The IUPAC name of 3,5-dichloro-4-[(2-fluorophenyl)methoxy]benzamide (CID 91682781) is 3,5-dichloro-4-[(2-fluorophenyl)methoxy]benzamide.
What is the SMILES notation for 3,5-dichloro-4-[(2-fluorophenyl)methoxy]benzamide?
The canonical SMILES for 3,5-dichloro-4-[(2-fluorophenyl)methoxy]benzamide is NC(=O)c1cc(Cl)c(OCc2ccccc2F)c(Cl)c1.
What is the InChIKey of 3,5-dichloro-4-[(2-fluorophenyl)methoxy]benzamide?
The InChIKey is LTIIZMRCHCUVMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10Cl2FNO2/c15-10-5-9(14(18)19)6-11(16)13(10)20-7-8-3-1-2-4-12(8)17/h1-6H,7H2,(H2,18,19).
What are the key properties of 3,5-dichloro-4-[(2-fluorophenyl)methoxy]benzamide?
3,5-dichloro-4-[(2-fluorophenyl)methoxy]benzamide has a molecular weight of 314.14 g/mol, XLogP of 3.81, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-4-[(2-fluorophenyl)methoxy]benzamide is sourced from PubChem (CID 91682781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).