2-(4-chlorophenyl)-N-(3-cyano-4-fluorophenyl)acetamide

C15H10ClFN2O — CID 62316311

IUPAC2-(4-chlorophenyl)-N-(3-cyano-4-fluorophenyl)acetamide
SMILESN#Cc1cc(NC(=O)Cc2ccc(Cl)cc2)ccc1F
InChIInChI=1S/C15H10ClFN2O/c16-12-3-1-10(2-4-12)7-15(20)19-13-5-6-14(17)11(8-13)9-18/h1-6,8H,7H2,(H,19,20)
InChIKeyMTFGOOKDSFOJQT-UHFFFAOYSA-N
MW288.71 g/mol
LogP3.53
Rot. Bonds3

About 2-(4-chlorophenyl)-N-(3-cyano-4-fluorophenyl)acetamide

2-(4-chlorophenyl)-N-(3-cyano-4-fluorophenyl)acetamide (PubChem CID 62316311) has the molecular formula C15H10ClFN2O and a molecular weight of 288.71 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-N-(3-cyano-4-fluorophenyl)acetamide.

Molecular Properties

Compound Name2-(4-chlorophenyl)-N-(3-cyano-4-fluorophenyl)acetamide
PubChem CID62316311
Molecular FormulaC15H10ClFN2O
Molecular Weight288.71 g/mol
Exact Mass288.05
IUPAC Name2-(4-chlorophenyl)-N-(3-cyano-4-fluorophenyl)acetamide
SMILESN#Cc1cc(NC(=O)Cc2ccc(Cl)cc2)ccc1F
InChIInChI=1S/C15H10ClFN2O/c16-12-3-1-10(2-4-12)7-15(20)19-13-5-6-14(17)11(8-13)9-18/h1-6,8H,7H2,(H,19,20)
InChIKeyMTFGOOKDSFOJQT-UHFFFAOYSA-N
XLogP3.53
TPSA52.89 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.71
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-cyano-4-fluorophenyl)-2-(3,4-dimethylphenyl)acetamide
CID 62551789
N-(3-cyano-4-fluorophenyl)-2-(2-methylphenyl)acetamide
CID 62315790
N-(4-chlorophenyl)-2-(4-fluorophenyl)acetamide
CID 7027780
N-(3-bromo-4-fluorophenyl)-2-(4-cyanophenyl)acetamide
CID 115661346
2-anilino-N-(3-cyano-4-fluorophenyl)acetamide
CID 62316865
N-(3-chloro-4-cyanophenyl)-2-[4-(trifluoromethyl)phenyl]acetamide
CID 24534784
N-(3-cyano-4-fluorophenyl)-2-cyclopentylacetamide
CID 62315620
2-chloro-N-(3-cyano-4-fluorophenyl)prop-2-enamide
CID 130856187
N-(3-chloro-4-cyanophenyl)-2-(3,4-dichlorophenyl)acetamide
CID 2448530
N-(3-cyano-4-fluorophenyl)-3-(propan-2-ylamino)propanamide
CID 55057780
2-(3-cyano-4-fluoroanilino)-N-phenylacetamide
CID 62317173
4-chloro-N-(3-cyano-4-fluorophenyl)-2-hydroxybenzamide
CID 62316486

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-N-(3-cyano-4-fluorophenyl)acetamide?
The IUPAC name of 2-(4-chlorophenyl)-N-(3-cyano-4-fluorophenyl)acetamide (CID 62316311) is 2-(4-chlorophenyl)-N-(3-cyano-4-fluorophenyl)acetamide.
What is the SMILES notation for 2-(4-chlorophenyl)-N-(3-cyano-4-fluorophenyl)acetamide?
The canonical SMILES for 2-(4-chlorophenyl)-N-(3-cyano-4-fluorophenyl)acetamide is N#Cc1cc(NC(=O)Cc2ccc(Cl)cc2)ccc1F.
What is the InChIKey of 2-(4-chlorophenyl)-N-(3-cyano-4-fluorophenyl)acetamide?
The InChIKey is MTFGOOKDSFOJQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10ClFN2O/c16-12-3-1-10(2-4-12)7-15(20)19-13-5-6-14(17)11(8-13)9-18/h1-6,8H,7H2,(H,19,20).
What are the key properties of 2-(4-chlorophenyl)-N-(3-cyano-4-fluorophenyl)acetamide?
2-(4-chlorophenyl)-N-(3-cyano-4-fluorophenyl)acetamide has a molecular weight of 288.71 g/mol, XLogP of 3.53, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-N-(3-cyano-4-fluorophenyl)acetamide is sourced from PubChem (CID 62316311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).