N-[2-(2-chloro-4-fluorophenyl)propan-2-yl]-2-(2-fluorophenyl)acetamide

C17H16ClF2NO — CID 86948842

IUPACN-[2-(2-chloro-4-fluorophenyl)propan-2-yl]-2-(2-fluorophenyl)acetamide
SMILESCC(C)(NC(=O)Cc1ccccc1F)c1ccc(F)cc1Cl
InChIInChI=1S/C17H16ClF2NO/c1-17(2,13-8-7-12(19)10-14(13)18)21-16(22)9-11-5-3-4-6-15(11)20/h3-8,10H,9H2,1-2H3,(H,21,22)
InChIKeyWCEVMDSZYGGSQG-UHFFFAOYSA-N
MW323.77 g/mol
LogP4.21
Rot. Bonds4

About N-[2-(2-chloro-4-fluorophenyl)propan-2-yl]-2-(2-fluorophenyl)acetamide

N-[2-(2-chloro-4-fluorophenyl)propan-2-yl]-2-(2-fluorophenyl)acetamide (PubChem CID 86948842) has the molecular formula C17H16ClF2NO and a molecular weight of 323.77 g/mol. Its IUPAC name is N-[2-(2-chloro-4-fluorophenyl)propan-2-yl]-2-(2-fluorophenyl)acetamide.

Molecular Properties

Compound NameN-[2-(2-chloro-4-fluorophenyl)propan-2-yl]-2-(2-fluorophenyl)acetamide
PubChem CID86948842
Molecular FormulaC17H16ClF2NO
Molecular Weight323.77 g/mol
Exact Mass323.09
IUPAC NameN-[2-(2-chloro-4-fluorophenyl)propan-2-yl]-2-(2-fluorophenyl)acetamide
SMILESCC(C)(NC(=O)Cc1ccccc1F)c1ccc(F)cc1Cl
InChIInChI=1S/C17H16ClF2NO/c1-17(2,13-8-7-12(19)10-14(13)18)21-16(22)9-11-5-3-4-6-15(11)20/h3-8,10H,9H2,1-2H3,(H,21,22)
InChIKeyWCEVMDSZYGGSQG-UHFFFAOYSA-N
XLogP4.21
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.77
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[2-(2,4-dichlorophenyl)propan-2-yl]-2-(4-fluorophenyl)acetamide
CID 110440041
N-[2-(2-chloro-4-fluorophenyl)propan-2-yl]-2,3-difluorobenzamide
CID 86948958
N-[2-(2-chloro-4-fluorophenyl)propan-2-yl]-2-[(4-fluorophenyl)methylcarbamoylamino]acetamide
CID 86949406
N-[2-(2-fluorophenyl)propan-2-yl]-2-(2-methoxyphenyl)acetamide
CID 110446497
2-[2-(2-chloro-4-fluorophenyl)propan-2-ylamino]-N-(2,6-dichlorophenyl)acetamide
CID 86949913
N-[2-(2-chloro-4-fluorophenyl)propan-2-yl]-3-methylthiophene-2-carboxamide
CID 86949000
N-[2-(2-chloro-4-fluorophenyl)propan-2-yl]-2-(4-nitrophenoxy)acetamide
CID 86948926
1-(2-chloro-4-fluorophenyl)-3-(2-fluorophenyl)-2-methylpropan-2-ol
CID 114832677
2-(2-chlorophenyl)-N-[2-(4-chlorophenyl)propan-2-yl]acetamide
CID 12807701
N-(1-chloro-3-methylpentan-3-yl)-2-(2-fluorophenyl)acetamide
CID 114153124
3-(benzenesulfonylmethyl)-N-[2-(2-chloro-4-fluorophenyl)propan-2-yl]benzamide
CID 86948895
N-(2,2-dimethylpropyl)-2-(2-fluorophenyl)acetamide
CID 110472861

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-chloro-4-fluorophenyl)propan-2-yl]-2-(2-fluorophenyl)acetamide?
The IUPAC name of N-[2-(2-chloro-4-fluorophenyl)propan-2-yl]-2-(2-fluorophenyl)acetamide (CID 86948842) is N-[2-(2-chloro-4-fluorophenyl)propan-2-yl]-2-(2-fluorophenyl)acetamide.
What is the SMILES notation for N-[2-(2-chloro-4-fluorophenyl)propan-2-yl]-2-(2-fluorophenyl)acetamide?
The canonical SMILES for N-[2-(2-chloro-4-fluorophenyl)propan-2-yl]-2-(2-fluorophenyl)acetamide is CC(C)(NC(=O)Cc1ccccc1F)c1ccc(F)cc1Cl.
What is the InChIKey of N-[2-(2-chloro-4-fluorophenyl)propan-2-yl]-2-(2-fluorophenyl)acetamide?
The InChIKey is WCEVMDSZYGGSQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16ClF2NO/c1-17(2,13-8-7-12(19)10-14(13)18)21-16(22)9-11-5-3-4-6-15(11)20/h3-8,10H,9H2,1-2H3,(H,21,22).
What are the key properties of N-[2-(2-chloro-4-fluorophenyl)propan-2-yl]-2-(2-fluorophenyl)acetamide?
N-[2-(2-chloro-4-fluorophenyl)propan-2-yl]-2-(2-fluorophenyl)acetamide has a molecular weight of 323.77 g/mol, XLogP of 4.21, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-chloro-4-fluorophenyl)propan-2-yl]-2-(2-fluorophenyl)acetamide is sourced from PubChem (CID 86948842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).