N-(4-cyanophenyl)-2,2-difluoropropanamide

C10H8F2N2O — CID 142563454

IUPACN-(4-cyanophenyl)-2,2-difluoropropanamide
SMILESCC(F)(F)C(=O)Nc1ccc(C#N)cc1
InChIInChI=1S/C10H8F2N2O/c1-10(11,12)9(15)14-8-4-2-7(6-13)3-5-8/h2-5H,1H3,(H,14,15)
InChIKeyORFPHBBDOJUHIY-UHFFFAOYSA-N
MW210.18 g/mol
LogP2.15
Rot. Bonds2

About N-(4-cyanophenyl)-2,2-difluoropropanamide

N-(4-cyanophenyl)-2,2-difluoropropanamide (PubChem CID 142563454) has the molecular formula C10H8F2N2O and a molecular weight of 210.18 g/mol. Its IUPAC name is N-(4-cyanophenyl)-2,2-difluoropropanamide.

Molecular Properties

Compound NameN-(4-cyanophenyl)-2,2-difluoropropanamide
PubChem CID142563454
Molecular FormulaC10H8F2N2O
Molecular Weight210.18 g/mol
Exact Mass210.06
IUPAC NameN-(4-cyanophenyl)-2,2-difluoropropanamide
SMILESCC(F)(F)C(=O)Nc1ccc(C#N)cc1
InChIInChI=1S/C10H8F2N2O/c1-10(11,12)9(15)14-8-4-2-7(6-13)3-5-8/h2-5H,1H3,(H,14,15)
InChIKeyORFPHBBDOJUHIY-UHFFFAOYSA-N
XLogP2.15
TPSA52.89 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.18
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-cyanophenyl)-2,2-difluoropropanamide;N-(4-cyanophenyl)formamide;ethane
CID 142563453
N-(4-cyanophenyl)-2,2-dimethylpropanamide
CID 4927441
N-(4-chlorophenyl)-N'-(4-cyanophenyl)-2,2-dimethylpropanediamide
CID 108969023
N-(4-cyanophenyl)-2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-heptadecafluorononanamide
CID 3376836
N-(4-cyanophenyl)-2,2-dimethyl-N'-(4-propan-2-ylphenyl)propanediamide
CID 108968519
8-(4-cyanoanilino)-2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoro-8-oxooctanoic acid
CID 123417730
N-(4-cyanophenyl)-N'-(4-methoxyphenyl)-2,2-dimethylpropanediamide
CID 108969446
N-(4-cyanophenyl)-2,2-dimethyl-N'-[2-(trifluoromethyl)phenyl]propanediamide
CID 108969688
1-(4-cyanophenyl)-3-(1,1,1,3,3-pentafluoro-2-methylbutan-2-yl)urea
CID 123852561
N'-tert-butyl-N-(4-cyanophenyl)oxamide
CID 108506832
N-(4-cyanophenyl)-N'-(2,4-difluorophenyl)-2,2-dimethylpropanediamide
CID 108970065
(2S)-N-(4-cyanophenyl)-3-(4-fluorophenoxy)-2-hydroxy-2-methylpropanamide
CID 142885777

Frequently Asked Questions

What is the IUPAC name of N-(4-cyanophenyl)-2,2-difluoropropanamide?
The IUPAC name of N-(4-cyanophenyl)-2,2-difluoropropanamide (CID 142563454) is N-(4-cyanophenyl)-2,2-difluoropropanamide.
What is the SMILES notation for N-(4-cyanophenyl)-2,2-difluoropropanamide?
The canonical SMILES for N-(4-cyanophenyl)-2,2-difluoropropanamide is CC(F)(F)C(=O)Nc1ccc(C#N)cc1.
What is the InChIKey of N-(4-cyanophenyl)-2,2-difluoropropanamide?
The InChIKey is ORFPHBBDOJUHIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8F2N2O/c1-10(11,12)9(15)14-8-4-2-7(6-13)3-5-8/h2-5H,1H3,(H,14,15).
What are the key properties of N-(4-cyanophenyl)-2,2-difluoropropanamide?
N-(4-cyanophenyl)-2,2-difluoropropanamide has a molecular weight of 210.18 g/mol, XLogP of 2.15, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-cyanophenyl)-2,2-difluoropropanamide is sourced from PubChem (CID 142563454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).