2-(2-chloroanilino)-2-(3-cyanophenyl)acetamide

C15H12ClN3O — CID 61006310

IUPAC2-(2-chloroanilino)-2-(3-cyanophenyl)acetamide
SMILESN#Cc1cccc(C(Nc2ccccc2Cl)C(N)=O)c1
InChIInChI=1S/C15H12ClN3O/c16-12-6-1-2-7-13(12)19-14(15(18)20)11-5-3-4-10(8-11)9-17/h1-8,14,19H,(H2,18,20)
InChIKeyUEOIPOWIRYCNLY-UHFFFAOYSA-N
MW285.73 g/mol
LogP2.85
Rot. Bonds4

About 2-(2-chloroanilino)-2-(3-cyanophenyl)acetamide

2-(2-chloroanilino)-2-(3-cyanophenyl)acetamide (PubChem CID 61006310) has the molecular formula C15H12ClN3O and a molecular weight of 285.73 g/mol. Its IUPAC name is 2-(2-chloroanilino)-2-(3-cyanophenyl)acetamide.

Molecular Properties

Compound Name2-(2-chloroanilino)-2-(3-cyanophenyl)acetamide
PubChem CID61006310
Molecular FormulaC15H12ClN3O
Molecular Weight285.73 g/mol
Exact Mass285.07
IUPAC Name2-(2-chloroanilino)-2-(3-cyanophenyl)acetamide
SMILESN#Cc1cccc(C(Nc2ccccc2Cl)C(N)=O)c1
InChIInChI=1S/C15H12ClN3O/c16-12-6-1-2-7-13(12)19-14(15(18)20)11-5-3-4-10(8-11)9-17/h1-8,14,19H,(H2,18,20)
InChIKeyUEOIPOWIRYCNLY-UHFFFAOYSA-N
XLogP2.85
TPSA78.91 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.73
LogP ≤ 52.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-cyanophenyl)-2-(4-fluoroanilino)acetamide
CID 61005173
2-(2-chloroanilino)-2-(4-propan-2-ylphenyl)acetamide
CID 61005849
2-(3-bromo-4-methylphenyl)-2-(2-chloroanilino)acetamide
CID 105401788
2-(2-chloroanilino)-2-(2-chlorophenyl)acetamide
CID 54892395
2-(2-chloroanilino)-2-[4-(dimethylamino)phenyl]acetamide
CID 61006312
2-(3-cyanophenyl)-2-[2-(dimethylamino)ethylamino]acetamide
CID 54892385
2-(2-chloroanilino)-2-(2,4-difluorophenyl)acetamide
CID 61006519
2-(2-chloroanilino)-2-(2-ethylphenyl)acetamide
CID 62416652
2-(2-chloro-4-cyanoanilino)-3-methylbutanamide
CID 106345598
N-(3-cyanophenyl)-2-(3,4-dichloroanilino)-2-phenylacetamide
CID 121264147
2-(2-chloro-4-cyanoanilino)butanamide
CID 107807872
methyl 2-(2-amino-5-cyanoanilino)-2-phenylacetate
CID 104711840

Frequently Asked Questions

What is the IUPAC name of 2-(2-chloroanilino)-2-(3-cyanophenyl)acetamide?
The IUPAC name of 2-(2-chloroanilino)-2-(3-cyanophenyl)acetamide (CID 61006310) is 2-(2-chloroanilino)-2-(3-cyanophenyl)acetamide.
What is the SMILES notation for 2-(2-chloroanilino)-2-(3-cyanophenyl)acetamide?
The canonical SMILES for 2-(2-chloroanilino)-2-(3-cyanophenyl)acetamide is N#Cc1cccc(C(Nc2ccccc2Cl)C(N)=O)c1.
What is the InChIKey of 2-(2-chloroanilino)-2-(3-cyanophenyl)acetamide?
The InChIKey is UEOIPOWIRYCNLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12ClN3O/c16-12-6-1-2-7-13(12)19-14(15(18)20)11-5-3-4-10(8-11)9-17/h1-8,14,19H,(H2,18,20).
What are the key properties of 2-(2-chloroanilino)-2-(3-cyanophenyl)acetamide?
2-(2-chloroanilino)-2-(3-cyanophenyl)acetamide has a molecular weight of 285.73 g/mol, XLogP of 2.85, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chloroanilino)-2-(3-cyanophenyl)acetamide is sourced from PubChem (CID 61006310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).