N-[(4-chlorophenyl)methyl]-4-fluorobenzamide

C14H11ClFNO — CID 2597668

IUPACN-[(4-chlorophenyl)methyl]-4-fluorobenzamide
SMILESO=C(NCc1ccc(Cl)cc1)c1ccc(F)cc1
InChIInChI=1S/C14H11ClFNO/c15-12-5-1-10(2-6-12)9-17-14(18)11-3-7-13(16)8-4-11/h1-8H,9H2,(H,17,18)
InChIKeyOKYFYJDSWFOFRO-UHFFFAOYSA-N
MW263.70 g/mol
LogP3.41
Rot. Bonds3

About N-[(4-chlorophenyl)methyl]-4-fluorobenzamide

N-[(4-chlorophenyl)methyl]-4-fluorobenzamide (PubChem CID 2597668) has the molecular formula C14H11ClFNO and a molecular weight of 263.70 g/mol. Its IUPAC name is N-[(4-chlorophenyl)methyl]-4-fluorobenzamide.

Molecular Properties

Compound NameN-[(4-chlorophenyl)methyl]-4-fluorobenzamide
PubChem CID2597668
Molecular FormulaC14H11ClFNO
Molecular Weight263.70 g/mol
Exact Mass263.05
IUPAC NameN-[(4-chlorophenyl)methyl]-4-fluorobenzamide
SMILESO=C(NCc1ccc(Cl)cc1)c1ccc(F)cc1
InChIInChI=1S/C14H11ClFNO/c15-12-5-1-10(2-6-12)9-17-14(18)11-3-7-13(16)8-4-11/h1-8H,9H2,(H,17,18)
InChIKeyOKYFYJDSWFOFRO-UHFFFAOYSA-N
XLogP3.41
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.70
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-N-[(4-chlorophenyl)methyl]-1-N-[(4-fluorophenyl)methyl]benzene-1,4-dicarboxamide
CID 109047229
N-[(4-chlorophenyl)methyl]-4-[[(4-fluorophenyl)sulfonylamino]methyl]benzamide
CID 5073710
3,4-difluoro-N-[(4-fluorophenyl)methyl]benzamide
CID 28558368
N-[2-(4-chlorophenyl)ethyl]-4-fluorobenzamide
CID 737426
4-N-(4-fluorophenyl)-1-N-[(4-fluorophenyl)methyl]benzene-1,4-dicarboxamide
CID 109047271
3-amino-4-fluoro-N-[(4-fluorophenyl)methyl]benzamide
CID 43436899
4-amino-N-[(4-chlorophenyl)methyl]-3-fluorobenzamide
CID 55102826
[4-[[(4-fluorobenzoyl)amino]methyl]phenyl]boronic acid
CID 140784388
3-chloro-N-[(4-fluorophenyl)methyl]-4-hydroxybenzamide
CID 4807069
4-chloro-N-[3-[2-[(4-fluorophenyl)methylcarbamothioyl]hydrazinyl]-3-oxopropyl]benzamide
CID 8942228
4-N-[(4-chlorophenyl)methyl]-1-N-prop-2-enylbenzene-1,4-dicarboxamide
CID 109043482
N-[[4-(carbamoylamino)phenyl]methyl]-4-chlorobenzamide
CID 52552945

Frequently Asked Questions

What is the IUPAC name of N-[(4-chlorophenyl)methyl]-4-fluorobenzamide?
The IUPAC name of N-[(4-chlorophenyl)methyl]-4-fluorobenzamide (CID 2597668) is N-[(4-chlorophenyl)methyl]-4-fluorobenzamide.
What is the SMILES notation for N-[(4-chlorophenyl)methyl]-4-fluorobenzamide?
The canonical SMILES for N-[(4-chlorophenyl)methyl]-4-fluorobenzamide is O=C(NCc1ccc(Cl)cc1)c1ccc(F)cc1.
What is the InChIKey of N-[(4-chlorophenyl)methyl]-4-fluorobenzamide?
The InChIKey is OKYFYJDSWFOFRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11ClFNO/c15-12-5-1-10(2-6-12)9-17-14(18)11-3-7-13(16)8-4-11/h1-8H,9H2,(H,17,18).
What are the key properties of N-[(4-chlorophenyl)methyl]-4-fluorobenzamide?
N-[(4-chlorophenyl)methyl]-4-fluorobenzamide has a molecular weight of 263.70 g/mol, XLogP of 3.41, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-chlorophenyl)methyl]-4-fluorobenzamide is sourced from PubChem (CID 2597668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).