N-[2-(2-bromoanilino)-2-oxoethyl]-2-fluorobenzamide

C15H12BrFN2O2 — CID 7719800

IUPACN-[2-(2-bromoanilino)-2-oxoethyl]-2-fluorobenzamide
SMILESO=C(CNC(=O)c1ccccc1F)Nc1ccccc1Br
InChIInChI=1S/C15H12BrFN2O2/c16-11-6-2-4-8-13(11)19-14(20)9-18-15(21)10-5-1-3-7-12(10)17/h1-8H,9H2,(H,18,21)(H,19,20)
InChIKeyFRNKNHIVFXOHCB-UHFFFAOYSA-N
MW351.18 g/mol
LogP2.96
Rot. Bonds4

About N-[2-(2-bromoanilino)-2-oxoethyl]-2-fluorobenzamide

N-[2-(2-bromoanilino)-2-oxoethyl]-2-fluorobenzamide (PubChem CID 7719800) has the molecular formula C15H12BrFN2O2 and a molecular weight of 351.18 g/mol. Its IUPAC name is N-[2-(2-bromoanilino)-2-oxoethyl]-2-fluorobenzamide.

Molecular Properties

Compound NameN-[2-(2-bromoanilino)-2-oxoethyl]-2-fluorobenzamide
PubChem CID7719800
Molecular FormulaC15H12BrFN2O2
Molecular Weight351.18 g/mol
Exact Mass350.01
IUPAC NameN-[2-(2-bromoanilino)-2-oxoethyl]-2-fluorobenzamide
SMILESO=C(CNC(=O)c1ccccc1F)Nc1ccccc1Br
InChIInChI=1S/C15H12BrFN2O2/c16-11-6-2-4-8-13(11)19-14(20)9-18-15(21)10-5-1-3-7-12(10)17/h1-8H,9H2,(H,18,21)(H,19,20)
InChIKeyFRNKNHIVFXOHCB-UHFFFAOYSA-N
XLogP2.96
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.18
LogP ≤ 52.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-anilino-N-[2-(2-bromoanilino)-2-oxoethyl]benzamide
CID 71904660
N-[2-(4-chloro-2-methylanilino)-2-oxoethyl]-2-fluorobenzamide
CID 26682013
N-[2-[[2-(2-bromoanilino)-2-oxoethyl]carbamoyl]phenyl]thiophene-2-carboxamide
CID 24681758
2-fluoro-N-[2-(4-methylanilino)-2-oxoethyl]benzamide
CID 3424482
methyl 2-[[2-[(2-bromobenzoyl)amino]acetyl]amino]benzoate
CID 112999796
2-fluoro-N-[2-[2-(4-methylphenoxy)anilino]-2-oxoethyl]benzamide
CID 17421842
N-(3-bromo-2-methylphenyl)-2-fluorobenzamide
CID 66606524
N-[(2-bromophenyl)methyl]-2-fluorobenzamide
CID 17173440
N-(2-bromoprop-2-enyl)-2-fluorobenzamide
CID 115594605
2-fluoro-N-[2-oxo-2-(propylamino)ethyl]benzamide
CID 9163327
2-fluoro-N-[2-(methoxyamino)-2-oxoethyl]benzamide
CID 60717185
2-[[2-(2-bromoanilino)-2-oxoethyl]amino]-N-methylbenzamide
CID 26543564

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-bromoanilino)-2-oxoethyl]-2-fluorobenzamide?
The IUPAC name of N-[2-(2-bromoanilino)-2-oxoethyl]-2-fluorobenzamide (CID 7719800) is N-[2-(2-bromoanilino)-2-oxoethyl]-2-fluorobenzamide.
What is the SMILES notation for N-[2-(2-bromoanilino)-2-oxoethyl]-2-fluorobenzamide?
The canonical SMILES for N-[2-(2-bromoanilino)-2-oxoethyl]-2-fluorobenzamide is O=C(CNC(=O)c1ccccc1F)Nc1ccccc1Br.
What is the InChIKey of N-[2-(2-bromoanilino)-2-oxoethyl]-2-fluorobenzamide?
The InChIKey is FRNKNHIVFXOHCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12BrFN2O2/c16-11-6-2-4-8-13(11)19-14(20)9-18-15(21)10-5-1-3-7-12(10)17/h1-8H,9H2,(H,18,21)(H,19,20).
What are the key properties of N-[2-(2-bromoanilino)-2-oxoethyl]-2-fluorobenzamide?
N-[2-(2-bromoanilino)-2-oxoethyl]-2-fluorobenzamide has a molecular weight of 351.18 g/mol, XLogP of 2.96, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-bromoanilino)-2-oxoethyl]-2-fluorobenzamide is sourced from PubChem (CID 7719800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).