N-[2-(2,5-difluorophenyl)ethyl]-2-(4-fluorophenyl)acetamide

C16H14F3NO — CID 110788175

IUPACN-[2-(2,5-difluorophenyl)ethyl]-2-(4-fluorophenyl)acetamide
SMILESO=C(Cc1ccc(F)cc1)NCCc1cc(F)ccc1F
InChIInChI=1S/C16H14F3NO/c17-13-3-1-11(2-4-13)9-16(21)20-8-7-12-10-14(18)5-6-15(12)19/h1-6,10H,7-9H2,(H,20,21)
InChIKeyOPGVUTFIJKSGJW-UHFFFAOYSA-N
MW293.29 g/mol
LogP3.01
Rot. Bonds5

About N-[2-(2,5-difluorophenyl)ethyl]-2-(4-fluorophenyl)acetamide

N-[2-(2,5-difluorophenyl)ethyl]-2-(4-fluorophenyl)acetamide (PubChem CID 110788175) has the molecular formula C16H14F3NO and a molecular weight of 293.29 g/mol. Its IUPAC name is N-[2-(2,5-difluorophenyl)ethyl]-2-(4-fluorophenyl)acetamide.

Molecular Properties

Compound NameN-[2-(2,5-difluorophenyl)ethyl]-2-(4-fluorophenyl)acetamide
PubChem CID110788175
Molecular FormulaC16H14F3NO
Molecular Weight293.29 g/mol
Exact Mass293.10
IUPAC NameN-[2-(2,5-difluorophenyl)ethyl]-2-(4-fluorophenyl)acetamide
SMILESO=C(Cc1ccc(F)cc1)NCCc1cc(F)ccc1F
InChIInChI=1S/C16H14F3NO/c17-13-3-1-11(2-4-13)9-16(21)20-8-7-12-10-14(18)5-6-15(12)19/h1-6,10H,7-9H2,(H,20,21)
InChIKeyOPGVUTFIJKSGJW-UHFFFAOYSA-N
XLogP3.01
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.29
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[2-(2,4-difluorophenyl)ethyl]-2-(4-fluorophenyl)acetamide
CID 110789003
N-[2-(2,5-difluorophenyl)ethyl]-2-(2-fluorophenyl)acetamide
CID 110788190
N-[2-(2,5-difluorophenyl)ethyl]propanamide
CID 71113752
2-amino-N-[2-(2,5-difluorophenyl)ethyl]acetamide
CID 82492756
N-[2-(4-chlorophenyl)ethyl]-2-(4-fluorophenyl)acetamide
CID 26516329
2-(2,5-difluorophenyl)ethylurea
CID 115168493
N-[2-(2,5-difluorophenyl)ethyl]-2-thiophen-2-ylacetamide
CID 110788173
N-[2-(2,5-difluorophenyl)ethyl]benzamide
CID 110788162
1-[2-(2,5-difluorophenyl)ethyl]-3-(2-hydroxyethyl)urea
CID 111573173
1-amino-N-[2-(2,5-difluorophenyl)ethyl]cyclopropane-1-carboxamide
CID 115189941
3-(2,5-difluorophenyl)-N-(2-hydroxyethyl)propanamide
CID 110902844
N-[2-(4,5-dimethoxy-2-methylphenyl)ethyl]-2-(4-fluorophenyl)acetamide
CID 110789806

Frequently Asked Questions

What is the IUPAC name of N-[2-(2,5-difluorophenyl)ethyl]-2-(4-fluorophenyl)acetamide?
The IUPAC name of N-[2-(2,5-difluorophenyl)ethyl]-2-(4-fluorophenyl)acetamide (CID 110788175) is N-[2-(2,5-difluorophenyl)ethyl]-2-(4-fluorophenyl)acetamide.
What is the SMILES notation for N-[2-(2,5-difluorophenyl)ethyl]-2-(4-fluorophenyl)acetamide?
The canonical SMILES for N-[2-(2,5-difluorophenyl)ethyl]-2-(4-fluorophenyl)acetamide is O=C(Cc1ccc(F)cc1)NCCc1cc(F)ccc1F.
What is the InChIKey of N-[2-(2,5-difluorophenyl)ethyl]-2-(4-fluorophenyl)acetamide?
The InChIKey is OPGVUTFIJKSGJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14F3NO/c17-13-3-1-11(2-4-13)9-16(21)20-8-7-12-10-14(18)5-6-15(12)19/h1-6,10H,7-9H2,(H,20,21).
What are the key properties of N-[2-(2,5-difluorophenyl)ethyl]-2-(4-fluorophenyl)acetamide?
N-[2-(2,5-difluorophenyl)ethyl]-2-(4-fluorophenyl)acetamide has a molecular weight of 293.29 g/mol, XLogP of 3.01, 5 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]-2-(4-fluorophenyl)acetamide is sourced from PubChem (CID 110788175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).