N-[(3-chloro-4-fluorophenyl)methyl]benzamide

C14H11ClFNO — CID 62721837

IUPACN-[(3-chloro-4-fluorophenyl)methyl]benzamide
SMILESO=C(NCc1ccc(F)c(Cl)c1)c1ccccc1
InChIInChI=1S/C14H11ClFNO/c15-12-8-10(6-7-13(12)16)9-17-14(18)11-4-2-1-3-5-11/h1-8H,9H2,(H,17,18)
InChIKeySSLGCVLBMUANGB-UHFFFAOYSA-N
MW263.70 g/mol
LogP3.41
Rot. Bonds3

About N-[(3-chloro-4-fluorophenyl)methyl]benzamide

N-[(3-chloro-4-fluorophenyl)methyl]benzamide (PubChem CID 62721837) has the molecular formula C14H11ClFNO and a molecular weight of 263.70 g/mol. Its IUPAC name is N-[(3-chloro-4-fluorophenyl)methyl]benzamide.

Molecular Properties

Compound NameN-[(3-chloro-4-fluorophenyl)methyl]benzamide
PubChem CID62721837
Molecular FormulaC14H11ClFNO
Molecular Weight263.70 g/mol
Exact Mass263.05
IUPAC NameN-[(3-chloro-4-fluorophenyl)methyl]benzamide
SMILESO=C(NCc1ccc(F)c(Cl)c1)c1ccccc1
InChIInChI=1S/C14H11ClFNO/c15-12-8-10(6-7-13(12)16)9-17-14(18)11-4-2-1-3-5-11/h1-8H,9H2,(H,17,18)
InChIKeySSLGCVLBMUANGB-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

3-[(3-chloro-4-fluorophenyl)methylcarbamoyl]benzoic acid
CID 62532100
N-[(3-chloro-4-fluorophenyl)methyl]-4-ethylbenzamide
CID 71822306
4-(aminomethyl)-N-[(3-chloro-4-fluorophenyl)methyl]benzamide
CID 62537954
3-bromo-N-[(3-chloro-4-fluorophenyl)methyl]-4-fluorobenzamide
CID 103707226
N-[(3-chloro-4-fluorophenyl)methyl]-4-fluoro-3-sulfanylbenzamide
CID 107028470
N-[(3-chloro-4-fluorophenyl)methyl]-5-iodothiophene-3-carboxamide
CID 78948526
5,6-dichloro-N-[(3-chloro-4-fluorophenyl)methyl]pyridine-3-carboxamide
CID 62537774
N-[(3-chloro-4-fluorophenyl)methyl]-2-fluoropyridine-4-carboxamide
CID 62537287
4-amino-N-[(3-chloro-4-fluorophenyl)methyl]-3-hydroxybenzamide
CID 107075151
N-[(3-chloro-4-fluorophenyl)methyl]-6-oxo-1H-pyridine-3-carboxamide
CID 46921250
3-chloro-4-fluoro-N-[[4-(hydroxymethyl)phenyl]methyl]benzamide
CID 107231671
3-chloro-4-fluoro-N-[(4-hydroxyphenyl)methyl]benzamide
CID 115731912

Frequently Asked Questions

What is the IUPAC name of N-[(3-chloro-4-fluorophenyl)methyl]benzamide?
The IUPAC name of N-[(3-chloro-4-fluorophenyl)methyl]benzamide (CID 62721837) is N-[(3-chloro-4-fluorophenyl)methyl]benzamide.
What is the SMILES notation for N-[(3-chloro-4-fluorophenyl)methyl]benzamide?
The canonical SMILES for N-[(3-chloro-4-fluorophenyl)methyl]benzamide is O=C(NCc1ccc(F)c(Cl)c1)c1ccccc1.
What is the InChIKey of N-[(3-chloro-4-fluorophenyl)methyl]benzamide?
The InChIKey is SSLGCVLBMUANGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11ClFNO/c15-12-8-10(6-7-13(12)16)9-17-14(18)11-4-2-1-3-5-11/h1-8H,9H2,(H,17,18).
What are the key properties of N-[(3-chloro-4-fluorophenyl)methyl]benzamide?
N-[(3-chloro-4-fluorophenyl)methyl]benzamide 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-[(3-chloro-4-fluorophenyl)methyl]benzamide is sourced from PubChem (CID 62721837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).