2-(3,4-dichlorophenyl)-N-[2-(3-fluorophenyl)ethyl]acetamide

C16H14Cl2FNO — CID 9051916

IUPAC2-(3,4-dichlorophenyl)-N-[2-(3-fluorophenyl)ethyl]acetamide
SMILESO=C(Cc1ccc(Cl)c(Cl)c1)NCCc1cccc(F)c1
InChIInChI=1S/C16H14Cl2FNO/c17-14-5-4-12(9-15(14)18)10-16(21)20-7-6-11-2-1-3-13(19)8-11/h1-5,8-9H,6-7,10H2,(H,20,21)
InChIKeySYWCZRVKDAOUHG-UHFFFAOYSA-N
MW326.20 g/mol
LogP4.03
Rot. Bonds5

About 2-(3,4-dichlorophenyl)-N-[2-(3-fluorophenyl)ethyl]acetamide

2-(3,4-dichlorophenyl)-N-[2-(3-fluorophenyl)ethyl]acetamide (PubChem CID 9051916) has the molecular formula C16H14Cl2FNO and a molecular weight of 326.20 g/mol. Its IUPAC name is 2-(3,4-dichlorophenyl)-N-[2-(3-fluorophenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-(3,4-dichlorophenyl)-N-[2-(3-fluorophenyl)ethyl]acetamide
PubChem CID9051916
Molecular FormulaC16H14Cl2FNO
Molecular Weight326.20 g/mol
Exact Mass325.04
IUPAC Name2-(3,4-dichlorophenyl)-N-[2-(3-fluorophenyl)ethyl]acetamide
SMILESO=C(Cc1ccc(Cl)c(Cl)c1)NCCc1cccc(F)c1
InChIInChI=1S/C16H14Cl2FNO/c17-14-5-4-12(9-15(14)18)10-16(21)20-7-6-11-2-1-3-13(19)8-11/h1-5,8-9H,6-7,10H2,(H,20,21)
InChIKeySYWCZRVKDAOUHG-UHFFFAOYSA-N
XLogP4.03
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.20
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[2-[2-(3-fluorophenyl)ethylamino]-2-oxoethyl]-2-phenylacetamide
CID 41365353
N-[2-(3,4-diethoxyphenyl)ethyl]-2-(3-fluorophenyl)acetamide
CID 26120183
2-(3-fluorophenyl)-N-[2-(2-methyl-1,3-benzoxazol-6-yl)ethyl]acetamide
CID 110791108
4-chloro-N-[2-(3-fluorophenyl)ethyl]-6-methylpyridine-3-carboxamide
CID 81226046
3-chloro-N-[2-(3-fluorophenyl)ethyl]-6-hydrazinylpyridine-2-carboxamide
CID 62242329
4-chloro-N-[2-(3-fluorophenyl)ethyl]benzamide
CID 9051887
N-[2-(3-fluorophenyl)ethyl]-2-(methylamino)acetamide
CID 43566280
5,6-dichloro-N-[2-(3-fluorophenyl)ethyl]pyridine-3-carboxamide
CID 43400487
3-chloro-N-[2-[2-(3-fluorophenyl)ethylamino]-2-oxoethyl]benzamide
CID 78812366
2-amino-3-chloro-N-[2-(3-fluorophenyl)ethyl]benzamide
CID 115540075
N-[2-(3-fluorophenyl)ethyl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide
CID 29292797
2-(3-fluorophenyl)ethylcarbamothioic S-acid
CID 115170336

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dichlorophenyl)-N-[2-(3-fluorophenyl)ethyl]acetamide?
The IUPAC name of 2-(3,4-dichlorophenyl)-N-[2-(3-fluorophenyl)ethyl]acetamide (CID 9051916) is 2-(3,4-dichlorophenyl)-N-[2-(3-fluorophenyl)ethyl]acetamide.
What is the SMILES notation for 2-(3,4-dichlorophenyl)-N-[2-(3-fluorophenyl)ethyl]acetamide?
The canonical SMILES for 2-(3,4-dichlorophenyl)-N-[2-(3-fluorophenyl)ethyl]acetamide is O=C(Cc1ccc(Cl)c(Cl)c1)NCCc1cccc(F)c1.
What is the InChIKey of 2-(3,4-dichlorophenyl)-N-[2-(3-fluorophenyl)ethyl]acetamide?
The InChIKey is SYWCZRVKDAOUHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14Cl2FNO/c17-14-5-4-12(9-15(14)18)10-16(21)20-7-6-11-2-1-3-13(19)8-11/h1-5,8-9H,6-7,10H2,(H,20,21).
What are the key properties of 2-(3,4-dichlorophenyl)-N-[2-(3-fluorophenyl)ethyl]acetamide?
2-(3,4-dichlorophenyl)-N-[2-(3-fluorophenyl)ethyl]acetamide has a molecular weight of 326.20 g/mol, XLogP of 4.03, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dichlorophenyl)-N-[2-(3-fluorophenyl)ethyl]acetamide is sourced from PubChem (CID 9051916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).