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

C17H16Cl2FNO — CID 110440041

IUPACN-[2-(2,4-dichlorophenyl)propan-2-yl]-2-(4-fluorophenyl)acetamide
SMILESCC(C)(NC(=O)Cc1ccc(F)cc1)c1ccc(Cl)cc1Cl
InChIInChI=1S/C17H16Cl2FNO/c1-17(2,14-8-5-12(18)10-15(14)19)21-16(22)9-11-3-6-13(20)7-4-11/h3-8,10H,9H2,1-2H3,(H,21,22)
InChIKeyWQSFTJRUNJQYRF-UHFFFAOYSA-N
MW340.23 g/mol
LogP4.73
Rot. Bonds4

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

N-[2-(2,4-dichlorophenyl)propan-2-yl]-2-(4-fluorophenyl)acetamide (PubChem CID 110440041) has the molecular formula C17H16Cl2FNO and a molecular weight of 340.23 g/mol. Its IUPAC name is N-[2-(2,4-dichlorophenyl)propan-2-yl]-2-(4-fluorophenyl)acetamide.

Molecular Properties

Compound NameN-[2-(2,4-dichlorophenyl)propan-2-yl]-2-(4-fluorophenyl)acetamide
PubChem CID110440041
Molecular FormulaC17H16Cl2FNO
Molecular Weight340.23 g/mol
Exact Mass339.06
IUPAC NameN-[2-(2,4-dichlorophenyl)propan-2-yl]-2-(4-fluorophenyl)acetamide
SMILESCC(C)(NC(=O)Cc1ccc(F)cc1)c1ccc(Cl)cc1Cl
InChIInChI=1S/C17H16Cl2FNO/c1-17(2,14-8-5-12(18)10-15(14)19)21-16(22)9-11-3-6-13(20)7-4-11/h3-8,10H,9H2,1-2H3,(H,21,22)
InChIKeyWQSFTJRUNJQYRF-UHFFFAOYSA-N
XLogP4.73
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.23
LogP ≤ 54.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[2-(2-chloro-4-fluorophenyl)propan-2-yl]-2-(2-fluorophenyl)acetamide
CID 86948842
N-[2-(2-chloro-4-fluorophenyl)propan-2-yl]-2-[(4-fluorophenyl)methylcarbamoylamino]acetamide
CID 86949406
N-[2-(2,4-dichlorophenyl)propan-2-yl]-3,4-difluorobenzamide
CID 110445693
2-(4-fluorophenyl)-N-(2-phenylpropan-2-yl)acetamide
CID 13118330
N-(5-chloro-2-methylphenyl)-2-(4-fluorophenyl)acetamide
CID 808427
N-[2-(2,4-dichloroanilino)-2-oxoethyl]-2-(4-fluorophenyl)acetamide
CID 113001259
2-(4-chlorophenyl)-N-[2-(2,4-difluorophenyl)-2-hydroxypropyl]acetamide
CID 111335471
N-(4-chloro-2-fluorophenyl)-2-(4-fluorophenyl)acetamide
CID 7961331
2-(4-fluorophenyl)-N-(2-thiophen-2-ylpropan-2-yl)acetamide
CID 110870545
N-[(Z)-1-(2,5-dichlorophenyl)ethylideneamino]-2-(4-fluorophenyl)acetamide
CID 7428850
N-[2-(2-chloro-4-fluorophenyl)propan-2-yl]-2,3-difluorobenzamide
CID 86948958
2-(4-aminophenyl)-N-[2-(2-chloro-4-fluorophenyl)-2-methylpropyl]acetamide;hydrochloride
CID 119786039

Frequently Asked Questions

What is the IUPAC name of N-[2-(2,4-dichlorophenyl)propan-2-yl]-2-(4-fluorophenyl)acetamide?
The IUPAC name of N-[2-(2,4-dichlorophenyl)propan-2-yl]-2-(4-fluorophenyl)acetamide (CID 110440041) is N-[2-(2,4-dichlorophenyl)propan-2-yl]-2-(4-fluorophenyl)acetamide.
What is the SMILES notation for N-[2-(2,4-dichlorophenyl)propan-2-yl]-2-(4-fluorophenyl)acetamide?
The canonical SMILES for N-[2-(2,4-dichlorophenyl)propan-2-yl]-2-(4-fluorophenyl)acetamide is CC(C)(NC(=O)Cc1ccc(F)cc1)c1ccc(Cl)cc1Cl.
What is the InChIKey of N-[2-(2,4-dichlorophenyl)propan-2-yl]-2-(4-fluorophenyl)acetamide?
The InChIKey is WQSFTJRUNJQYRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16Cl2FNO/c1-17(2,14-8-5-12(18)10-15(14)19)21-16(22)9-11-3-6-13(20)7-4-11/h3-8,10H,9H2,1-2H3,(H,21,22).
What are the key properties of N-[2-(2,4-dichlorophenyl)propan-2-yl]-2-(4-fluorophenyl)acetamide?
N-[2-(2,4-dichlorophenyl)propan-2-yl]-2-(4-fluorophenyl)acetamide has a molecular weight of 340.23 g/mol, XLogP of 4.73, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2,4-dichlorophenyl)propan-2-yl]-2-(4-fluorophenyl)acetamide is sourced from PubChem (CID 110440041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).