5-chloro-2-fluoro-N-[(1R)-1-(4-fluorophenyl)ethyl]benzamide

C15H12ClF2NO — CID 92538270

IUPAC5-chloro-2-fluoro-N-[(1R)-1-(4-fluorophenyl)ethyl]benzamide
SMILESC[C@@H](NC(=O)c1cc(Cl)ccc1F)c1ccc(F)cc1
InChIInChI=1S/C15H12ClF2NO/c1-9(10-2-5-12(17)6-3-10)19-15(20)13-8-11(16)4-7-14(13)18/h2-9H,1H3,(H,19,20)/t9-/m1/s1
InChIKeyQJBOFQJFOVPXTP-SECBINFHSA-N
MW295.72 g/mol
LogP4.11
Rot. Bonds3

About 5-chloro-2-fluoro-N-[(1R)-1-(4-fluorophenyl)ethyl]benzamide

5-chloro-2-fluoro-N-[(1R)-1-(4-fluorophenyl)ethyl]benzamide (PubChem CID 92538270) has the molecular formula C15H12ClF2NO and a molecular weight of 295.72 g/mol. Its IUPAC name is 5-chloro-2-fluoro-N-[(1R)-1-(4-fluorophenyl)ethyl]benzamide.

Molecular Properties

Compound Name5-chloro-2-fluoro-N-[(1R)-1-(4-fluorophenyl)ethyl]benzamide
PubChem CID92538270
Molecular FormulaC15H12ClF2NO
Molecular Weight295.72 g/mol
Exact Mass295.06
IUPAC Name5-chloro-2-fluoro-N-[(1R)-1-(4-fluorophenyl)ethyl]benzamide
SMILESC[C@@H](NC(=O)c1cc(Cl)ccc1F)c1ccc(F)cc1
InChIInChI=1S/C15H12ClF2NO/c1-9(10-2-5-12(17)6-3-10)19-15(20)13-8-11(16)4-7-14(13)18/h2-9H,1H3,(H,19,20)/t9-/m1/s1
InChIKeyQJBOFQJFOVPXTP-SECBINFHSA-N
XLogP4.11
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.72
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

5-chloro-N-[1-(3,4-dichlorophenyl)ethyl]-2-fluorobenzamide
CID 60674629
4-chloro-N-[1-(4-fluorophenyl)ethyl]benzamide
CID 4780866
5-chloro-N-[1-(3-chlorophenyl)ethyl]-2-fluorobenzamide
CID 60674500
5-chloro-2-fluoro-N-[(1S)-1-(4-sulfamoylphenyl)ethyl]benzamide
CID 27759607
2-amino-N-[(1S)-1-(4-chlorophenyl)ethyl]-5-fluorobenzamide
CID 81354408
5-chloro-N-[(1S)-1-(3,4-dimethoxyphenyl)ethyl]-2-fluorobenzamide
CID 94049074
4-chloro-2-fluoro-N-[(1R)-1-phenylethyl]benzamide
CID 26004040
5-chloro-2-fluoro-N-[(1R)-1-[3-(trifluoromethyl)phenyl]ethyl]benzamide
CID 25444134
N-[1-(3,4-dichlorophenyl)ethyl]-2-fluoro-5-methylbenzamide
CID 62513333
2,5-dichloro-N-[1-(4-fluorophenyl)ethyl]pyridine-4-carboxamide
CID 114918156
N-[1-(4-bromophenyl)ethyl]-2-fluoro-5-methylbenzamide
CID 62515712
5-chloro-N-[(1S)-1-(5-chlorothiophen-2-yl)ethyl]-2-fluorobenzamide
CID 51938203

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-fluoro-N-[(1R)-1-(4-fluorophenyl)ethyl]benzamide?
The IUPAC name of 5-chloro-2-fluoro-N-[(1R)-1-(4-fluorophenyl)ethyl]benzamide (CID 92538270) is 5-chloro-2-fluoro-N-[(1R)-1-(4-fluorophenyl)ethyl]benzamide.
What is the SMILES notation for 5-chloro-2-fluoro-N-[(1R)-1-(4-fluorophenyl)ethyl]benzamide?
The canonical SMILES for 5-chloro-2-fluoro-N-[(1R)-1-(4-fluorophenyl)ethyl]benzamide is C[C@@H](NC(=O)c1cc(Cl)ccc1F)c1ccc(F)cc1.
What is the InChIKey of 5-chloro-2-fluoro-N-[(1R)-1-(4-fluorophenyl)ethyl]benzamide?
The InChIKey is QJBOFQJFOVPXTP-SECBINFHSA-N. The full InChI is InChI=1S/C15H12ClF2NO/c1-9(10-2-5-12(17)6-3-10)19-15(20)13-8-11(16)4-7-14(13)18/h2-9H,1H3,(H,19,20)/t9-/m1/s1.
What are the key properties of 5-chloro-2-fluoro-N-[(1R)-1-(4-fluorophenyl)ethyl]benzamide?
5-chloro-2-fluoro-N-[(1R)-1-(4-fluorophenyl)ethyl]benzamide has a molecular weight of 295.72 g/mol, XLogP of 4.11, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-fluoro-N-[(1R)-1-(4-fluorophenyl)ethyl]benzamide is sourced from PubChem (CID 92538270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).