2-chloro-N-[2-(3-fluorophenyl)-2-oxoethyl]benzamide

C15H11ClFNO2 — CID 134123734

IUPAC2-chloro-N-[2-(3-fluorophenyl)-2-oxoethyl]benzamide
SMILESO=C(CNC(=O)c1ccccc1Cl)c1cccc(F)c1
InChIInChI=1S/C15H11ClFNO2/c16-13-7-2-1-6-12(13)15(20)18-9-14(19)10-4-3-5-11(17)8-10/h1-8H,9H2,(H,18,20)
InChIKeyNMFSBVSPFVCFNZ-UHFFFAOYSA-N
MW291.71 g/mol
LogP3.09
Rot. Bonds4

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

2-chloro-N-[2-(3-fluorophenyl)-2-oxoethyl]benzamide (PubChem CID 134123734) has the molecular formula C15H11ClFNO2 and a molecular weight of 291.71 g/mol. Its IUPAC name is 2-chloro-N-[2-(3-fluorophenyl)-2-oxoethyl]benzamide.

Molecular Properties

Compound Name2-chloro-N-[2-(3-fluorophenyl)-2-oxoethyl]benzamide
PubChem CID134123734
Molecular FormulaC15H11ClFNO2
Molecular Weight291.71 g/mol
Exact Mass291.05
IUPAC Name2-chloro-N-[2-(3-fluorophenyl)-2-oxoethyl]benzamide
SMILESO=C(CNC(=O)c1ccccc1Cl)c1cccc(F)c1
InChIInChI=1S/C15H11ClFNO2/c16-13-7-2-1-6-12(13)15(20)18-9-14(19)10-4-3-5-11(17)8-10/h1-8H,9H2,(H,18,20)
InChIKeyNMFSBVSPFVCFNZ-UHFFFAOYSA-N
XLogP3.09
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.71
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-[2-(2-chlorobenzoyl)hydrazinyl]-2-oxoethyl]-3-fluorobenzamide
CID 35929184
(2,6-dichlorophenyl)methyl 2-[(3-fluorobenzoyl)amino]acetate
CID 8662771
N-[1-(2-chlorophenyl)ethylideneamino]-3-fluorobenzamide
CID 4181605
2-(2-chlorophenyl)sulfonyl-1-(3-fluorophenyl)ethanone
CID 64642512
1-(5-chloro-2-hydroxyphenyl)-3-(3-fluorophenyl)propane-1,3-dione
CID 776185
N-[2-[(2-chlorobenzoyl)amino]ethyl]-2-fluorobenzamide
CID 108538189
2-chloro-N-[(2E)-2-(3-fluorophenyl)-2-[[4-(trifluoromethoxy)phenyl]carbamoylhydrazinylidene]ethyl]benzamide
CID 134123737
N-[2-(4-fluorophenyl)-2-oxoethyl]-2-methylbenzamide
CID 94280945
3,4-dichloro-N-[2-[(3-fluorobenzoyl)amino]ethyl]benzamide
CID 34819338
N-[2-(2,4-dichloroanilino)-2-oxoethyl]-3-fluorobenzamide
CID 113001247
N-[2-[2-(2-chlorobenzoyl)hydrazinyl]-2-oxoethyl]-2-fluorobenzamide
CID 35930552
2-chloro-N-[2-[[3-(trifluoromethyl)benzoyl]amino]ethyl]benzamide
CID 55659179

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[2-(3-fluorophenyl)-2-oxoethyl]benzamide?
The IUPAC name of 2-chloro-N-[2-(3-fluorophenyl)-2-oxoethyl]benzamide (CID 134123734) is 2-chloro-N-[2-(3-fluorophenyl)-2-oxoethyl]benzamide.
What is the SMILES notation for 2-chloro-N-[2-(3-fluorophenyl)-2-oxoethyl]benzamide?
The canonical SMILES for 2-chloro-N-[2-(3-fluorophenyl)-2-oxoethyl]benzamide is O=C(CNC(=O)c1ccccc1Cl)c1cccc(F)c1.
What is the InChIKey of 2-chloro-N-[2-(3-fluorophenyl)-2-oxoethyl]benzamide?
The InChIKey is NMFSBVSPFVCFNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11ClFNO2/c16-13-7-2-1-6-12(13)15(20)18-9-14(19)10-4-3-5-11(17)8-10/h1-8H,9H2,(H,18,20).
What are the key properties of 2-chloro-N-[2-(3-fluorophenyl)-2-oxoethyl]benzamide?
2-chloro-N-[2-(3-fluorophenyl)-2-oxoethyl]benzamide has a molecular weight of 291.71 g/mol, XLogP of 3.09, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[2-(3-fluorophenyl)-2-oxoethyl]benzamide is sourced from PubChem (CID 134123734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).