4-chloro-N-[2-(3-fluorophenyl)ethyl]benzamide

C15H13ClFNO — CID 9051887

IUPAC4-chloro-N-[2-(3-fluorophenyl)ethyl]benzamide
SMILESO=C(NCCc1cccc(F)c1)c1ccc(Cl)cc1
InChIInChI=1S/C15H13ClFNO/c16-13-6-4-12(5-7-13)15(19)18-9-8-11-2-1-3-14(17)10-11/h1-7,10H,8-9H2,(H,18,19)
InChIKeyQSUYHCJYIACFAE-UHFFFAOYSA-N
MW277.73 g/mol
LogP3.45
Rot. Bonds4

About 4-chloro-N-[2-(3-fluorophenyl)ethyl]benzamide

4-chloro-N-[2-(3-fluorophenyl)ethyl]benzamide (PubChem CID 9051887) has the molecular formula C15H13ClFNO and a molecular weight of 277.73 g/mol. Its IUPAC name is 4-chloro-N-[2-(3-fluorophenyl)ethyl]benzamide.

Molecular Properties

Compound Name4-chloro-N-[2-(3-fluorophenyl)ethyl]benzamide
PubChem CID9051887
Molecular FormulaC15H13ClFNO
Molecular Weight277.73 g/mol
Exact Mass277.07
IUPAC Name4-chloro-N-[2-(3-fluorophenyl)ethyl]benzamide
SMILESO=C(NCCc1cccc(F)c1)c1ccc(Cl)cc1
InChIInChI=1S/C15H13ClFNO/c16-13-6-4-12(5-7-13)15(19)18-9-8-11-2-1-3-14(17)10-11/h1-7,10H,8-9H2,(H,18,19)
InChIKeyQSUYHCJYIACFAE-UHFFFAOYSA-N
XLogP3.45
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.73
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-amino-N-[2-(3-fluorophenyl)ethyl]benzamide
CID 43565816
N-[2-(4-chlorophenyl)ethyl]-4-fluorobenzamide
CID 737426
5,6-dichloro-N-[2-(3-fluorophenyl)ethyl]pyridine-3-carboxamide
CID 43400487
2-chloro-N-[2-(3-fluorophenyl)ethyl]pyridine-4-carboxamide
CID 32695783
4-chloro-N-[2-(3-methoxyphenyl)ethyl]benzamide
CID 113098173
3-chloro-N-[2-[2-(3-fluorophenyl)ethylamino]-2-oxoethyl]benzamide
CID 78812366
N-[2-(3-chlorophenyl)ethyl]-4-fluoro-3-methylbenzamide
CID 63213299
7-N-[2-(3-fluorophenyl)ethyl]-2-N-hydroxynaphthalene-2,7-dicarboxamide
CID 87467122
4-chloro-N-[4-[2-(3-chlorophenyl)ethylamino]-4-oxobutyl]benzamide
CID 27838626
4-chloro-N-[2-(3-fluorophenyl)ethyl]pyridine-2-carboxamide
CID 31799254
1-N,3-N-bis[2-(4-chlorophenyl)ethyl]benzene-1,3-dicarboxamide
CID 1242332
2,5-dichloro-N-[2-(3-fluorophenyl)ethyl]thiophene-3-carboxamide
CID 78812511

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-[2-(3-fluorophenyl)ethyl]benzamide?
The IUPAC name of 4-chloro-N-[2-(3-fluorophenyl)ethyl]benzamide (CID 9051887) is 4-chloro-N-[2-(3-fluorophenyl)ethyl]benzamide.
What is the SMILES notation for 4-chloro-N-[2-(3-fluorophenyl)ethyl]benzamide?
The canonical SMILES for 4-chloro-N-[2-(3-fluorophenyl)ethyl]benzamide is O=C(NCCc1cccc(F)c1)c1ccc(Cl)cc1.
What is the InChIKey of 4-chloro-N-[2-(3-fluorophenyl)ethyl]benzamide?
The InChIKey is QSUYHCJYIACFAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13ClFNO/c16-13-6-4-12(5-7-13)15(19)18-9-8-11-2-1-3-14(17)10-11/h1-7,10H,8-9H2,(H,18,19).
What are the key properties of 4-chloro-N-[2-(3-fluorophenyl)ethyl]benzamide?
4-chloro-N-[2-(3-fluorophenyl)ethyl]benzamide has a molecular weight of 277.73 g/mol, XLogP of 3.45, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-[2-(3-fluorophenyl)ethyl]benzamide is sourced from PubChem (CID 9051887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).