N-[2-(2,5-difluorophenyl)ethyl]benzamide

C15H13F2NO — CID 110788162

IUPACN-[2-(2,5-difluorophenyl)ethyl]benzamide
SMILESO=C(NCCc1cc(F)ccc1F)c1ccccc1
InChIInChI=1S/C15H13F2NO/c16-13-6-7-14(17)12(10-13)8-9-18-15(19)11-4-2-1-3-5-11/h1-7,10H,8-9H2,(H,18,19)
InChIKeyLCQWCPAHFIERNJ-UHFFFAOYSA-N
MW261.27 g/mol
LogP2.94
Rot. Bonds4

About N-[2-(2,5-difluorophenyl)ethyl]benzamide

N-[2-(2,5-difluorophenyl)ethyl]benzamide (PubChem CID 110788162) has the molecular formula C15H13F2NO and a molecular weight of 261.27 g/mol. Its IUPAC name is N-[2-(2,5-difluorophenyl)ethyl]benzamide.

Molecular Properties

Compound NameN-[2-(2,5-difluorophenyl)ethyl]benzamide
PubChem CID110788162
Molecular FormulaC15H13F2NO
Molecular Weight261.27 g/mol
Exact Mass261.10
IUPAC NameN-[2-(2,5-difluorophenyl)ethyl]benzamide
SMILESO=C(NCCc1cc(F)ccc1F)c1ccccc1
InChIInChI=1S/C15H13F2NO/c16-13-6-7-14(17)12(10-13)8-9-18-15(19)11-4-2-1-3-5-11/h1-7,10H,8-9H2,(H,18,19)
InChIKeyLCQWCPAHFIERNJ-UHFFFAOYSA-N
XLogP2.94
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.27
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[2-(2,5-difluorophenyl)ethyl]-2-(2-fluorophenyl)acetamide
CID 110788190
N-[2-(2,5-difluorophenyl)ethyl]-4-methoxybenzamide
CID 110788169
N-[2-(2,5-difluorophenyl)ethyl]-2-(4-fluorophenyl)acetamide
CID 110788175
2-(2,5-difluorophenyl)ethylurea
CID 115168493
2-amino-N-[2-(2,5-difluorophenyl)ethyl]acetamide
CID 82492756
N-[2-(2,5-difluorophenyl)ethyl]propanamide
CID 71113752
1-[2-(2,5-difluorophenyl)ethyl]-3-(2-hydroxyethyl)urea
CID 111573173
N-[3-[[N'-[(2,5-difluorophenyl)methyl]-N-ethylcarbamimidoyl]amino]propyl]benzamide
CID 111903291
4-bromo-N-[2-(2-fluorophenyl)ethyl]benzamide
CID 8636623
2-(2-fluorophenyl)-N-[2-(2-fluorophenyl)ethyl]acetamide
CID 78792118
N-[2-(5-chloro-2-fluorophenyl)ethyl]pyridine-4-carboxamide
CID 110790543
N-[3-[[N'-[(2,5-difluorophenyl)methyl]-N-ethylcarbamimidoyl]amino]propyl]benzamide;hydroiodide
CID 111903290

Frequently Asked Questions

What is the IUPAC name of N-[2-(2,5-difluorophenyl)ethyl]benzamide?
The IUPAC name of N-[2-(2,5-difluorophenyl)ethyl]benzamide (CID 110788162) is N-[2-(2,5-difluorophenyl)ethyl]benzamide.
What is the SMILES notation for N-[2-(2,5-difluorophenyl)ethyl]benzamide?
The canonical SMILES for N-[2-(2,5-difluorophenyl)ethyl]benzamide is O=C(NCCc1cc(F)ccc1F)c1ccccc1.
What is the InChIKey of N-[2-(2,5-difluorophenyl)ethyl]benzamide?
The InChIKey is LCQWCPAHFIERNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13F2NO/c16-13-6-7-14(17)12(10-13)8-9-18-15(19)11-4-2-1-3-5-11/h1-7,10H,8-9H2,(H,18,19).
What are the key properties of N-[2-(2,5-difluorophenyl)ethyl]benzamide?
N-[2-(2,5-difluorophenyl)ethyl]benzamide has a molecular weight of 261.27 g/mol, XLogP of 2.94, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2,5-difluorophenyl)ethyl]benzamide is sourced from PubChem (CID 110788162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).