N-(3-chloro-4-fluorophenyl)-3-phenylmethoxybenzamide

C20H15ClFNO2 — CID 1074686

IUPACN-(3-chloro-4-fluorophenyl)-3-phenylmethoxybenzamide
SMILESO=C(Nc1ccc(F)c(Cl)c1)c1cccc(OCc2ccccc2)c1
InChIInChI=1S/C20H15ClFNO2/c21-18-12-16(9-10-19(18)22)23-20(24)15-7-4-8-17(11-15)25-13-14-5-2-1-3-6-14/h1-12H,13H2,(H,23,24)
InChIKeyUTSGWSCIYDQNBU-UHFFFAOYSA-N
MW355.80 g/mol
LogP5.31
Rot. Bonds5

About N-(3-chloro-4-fluorophenyl)-3-phenylmethoxybenzamide

N-(3-chloro-4-fluorophenyl)-3-phenylmethoxybenzamide (PubChem CID 1074686) has the molecular formula C20H15ClFNO2 and a molecular weight of 355.80 g/mol. Its IUPAC name is N-(3-chloro-4-fluorophenyl)-3-phenylmethoxybenzamide.

Molecular Properties

Compound NameN-(3-chloro-4-fluorophenyl)-3-phenylmethoxybenzamide
PubChem CID1074686
Molecular FormulaC20H15ClFNO2
Molecular Weight355.80 g/mol
Exact Mass355.08
IUPAC NameN-(3-chloro-4-fluorophenyl)-3-phenylmethoxybenzamide
SMILESO=C(Nc1ccc(F)c(Cl)c1)c1cccc(OCc2ccccc2)c1
InChIInChI=1S/C20H15ClFNO2/c21-18-12-16(9-10-19(18)22)23-20(24)15-7-4-8-17(11-15)25-13-14-5-2-1-3-6-14/h1-12H,13H2,(H,23,24)
InChIKeyUTSGWSCIYDQNBU-UHFFFAOYSA-N
XLogP5.31
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500355.80
LogP ≤ 55.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(3-chloro-4-fluorophenyl)carbamothioyl]-3-phenylmethoxybenzamide
CID 1258743
N-(3,4-dichlorophenyl)-3-phenylmethoxybenzamide
CID 17148514
N-benzyl-3-[2-(3-chloro-4-fluoroanilino)-2-oxoethoxy]benzamide
CID 7492272
1-N,3-N-bis(3,4-dichlorophenyl)-5-phenylmethoxybenzene-1,3-dicarboxamide
CID 10303103
N-(4-acetamido-3-chlorophenyl)-3-[(4-fluorophenyl)methoxy]benzamide
CID 43041597
3-methoxy-N-(3-phenylmethoxyphenyl)benzamide
CID 135564193
3-phenylmethoxy-N-(4-sulfamoylphenyl)benzamide
CID 1163178
N-[4-(dimethylamino)phenyl]-3-phenylmethoxybenzamide
CID 23733067
N-(3-chloro-4-fluorophenyl)-3-pyridin-4-yloxybenzamide
CID 91103914
N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-3-phenylmethoxybenzamide
CID 17102550
N-[3-[(3-chloro-4-fluorophenyl)carbamoyl]phenyl]-2-(2-phenylethoxy)benzamide
CID 26166889
3-phenylmethoxy-N-[4-(pyrrolidin-1-ylmethyl)phenyl]benzamide
CID 3296520

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-4-fluorophenyl)-3-phenylmethoxybenzamide?
The IUPAC name of N-(3-chloro-4-fluorophenyl)-3-phenylmethoxybenzamide (CID 1074686) is N-(3-chloro-4-fluorophenyl)-3-phenylmethoxybenzamide.
What is the SMILES notation for N-(3-chloro-4-fluorophenyl)-3-phenylmethoxybenzamide?
The canonical SMILES for N-(3-chloro-4-fluorophenyl)-3-phenylmethoxybenzamide is O=C(Nc1ccc(F)c(Cl)c1)c1cccc(OCc2ccccc2)c1.
What is the InChIKey of N-(3-chloro-4-fluorophenyl)-3-phenylmethoxybenzamide?
The InChIKey is UTSGWSCIYDQNBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15ClFNO2/c21-18-12-16(9-10-19(18)22)23-20(24)15-7-4-8-17(11-15)25-13-14-5-2-1-3-6-14/h1-12H,13H2,(H,23,24).
What are the key properties of N-(3-chloro-4-fluorophenyl)-3-phenylmethoxybenzamide?
N-(3-chloro-4-fluorophenyl)-3-phenylmethoxybenzamide has a molecular weight of 355.80 g/mol, XLogP of 5.31, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-4-fluorophenyl)-3-phenylmethoxybenzamide is sourced from PubChem (CID 1074686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).