2-(2-cyanophenyl)-2-(2-methylanilino)acetamide

C16H15N3O — CID 107936349

IUPAC2-(2-cyanophenyl)-2-(2-methylanilino)acetamide
SMILESCc1ccccc1NC(C(N)=O)c1ccccc1C#N
InChIInChI=1S/C16H15N3O/c1-11-6-2-5-9-14(11)19-15(16(18)20)13-8-4-3-7-12(13)10-17/h2-9,15,19H,1H3,(H2,18,20)
InChIKeyMBGISQNFMMQIPY-UHFFFAOYSA-N
MW265.32 g/mol
LogP2.51
Rot. Bonds4

About 2-(2-cyanophenyl)-2-(2-methylanilino)acetamide

2-(2-cyanophenyl)-2-(2-methylanilino)acetamide (PubChem CID 107936349) has the molecular formula C16H15N3O and a molecular weight of 265.32 g/mol. Its IUPAC name is 2-(2-cyanophenyl)-2-(2-methylanilino)acetamide.

Molecular Properties

Compound Name2-(2-cyanophenyl)-2-(2-methylanilino)acetamide
PubChem CID107936349
Molecular FormulaC16H15N3O
Molecular Weight265.32 g/mol
Exact Mass265.12
IUPAC Name2-(2-cyanophenyl)-2-(2-methylanilino)acetamide
SMILESCc1ccccc1NC(C(N)=O)c1ccccc1C#N
InChIInChI=1S/C16H15N3O/c1-11-6-2-5-9-14(11)19-15(16(18)20)13-8-4-3-7-12(13)10-17/h2-9,15,19H,1H3,(H2,18,20)
InChIKeyMBGISQNFMMQIPY-UHFFFAOYSA-N
XLogP2.51
TPSA78.91 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.32
LogP ≤ 52.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-methylanilino)-2-(3-methylthiophen-2-yl)acetamide
CID 61346770
2-(1-amino-2-oxopropyl)benzonitrile
CID 55294703
2-[1-(2-methylphenyl)ethylamino]benzonitrile
CID 43178628
1-(2-cyanophenyl)-3-(2-methyl-6-propan-2-ylphenyl)urea
CID 108991723
3-methyl-2-(2-methylanilino)butanamide
CID 60679565
2-(2-bromoanilino)-2-(2-bromophenyl)acetamide
CID 54892174
2-(2-chloroanilino)-2-(2-chlorophenyl)acetamide
CID 54892395
methyl (2S)-2-amino-2-(2-cyanophenyl)acetate
CID 130692626
(2-cyanophenyl)urea
CID 13155570
diethyl 2-(2-cyanophenyl)propanedioate
CID 13050091
2-amino-N-(2-cyanophenyl)-6-methylbenzamide
CID 16781189
ethyl 2-(2-cyanophenyl)-2-hydroxyacetate
CID 75251664

Frequently Asked Questions

What is the IUPAC name of 2-(2-cyanophenyl)-2-(2-methylanilino)acetamide?
The IUPAC name of 2-(2-cyanophenyl)-2-(2-methylanilino)acetamide (CID 107936349) is 2-(2-cyanophenyl)-2-(2-methylanilino)acetamide.
What is the SMILES notation for 2-(2-cyanophenyl)-2-(2-methylanilino)acetamide?
The canonical SMILES for 2-(2-cyanophenyl)-2-(2-methylanilino)acetamide is Cc1ccccc1NC(C(N)=O)c1ccccc1C#N.
What is the InChIKey of 2-(2-cyanophenyl)-2-(2-methylanilino)acetamide?
The InChIKey is MBGISQNFMMQIPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O/c1-11-6-2-5-9-14(11)19-15(16(18)20)13-8-4-3-7-12(13)10-17/h2-9,15,19H,1H3,(H2,18,20).
What are the key properties of 2-(2-cyanophenyl)-2-(2-methylanilino)acetamide?
2-(2-cyanophenyl)-2-(2-methylanilino)acetamide has a molecular weight of 265.32 g/mol, XLogP of 2.51, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyanophenyl)-2-(2-methylanilino)acetamide is sourced from PubChem (CID 107936349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).