2-anilino-N-phenylprop-2-enamide

C15H14N2O — CID 20522355

IUPAC2-anilino-N-phenylprop-2-enamide
SMILESC=C(Nc1ccccc1)C(=O)Nc1ccccc1
InChIInChI=1S/C15H14N2O/c1-12(16-13-8-4-2-5-9-13)15(18)17-14-10-6-3-7-11-14/h2-11,16H,1H2,(H,17,18)
InChIKeyXGPACZAFBRDWDR-UHFFFAOYSA-N
MW238.29 g/mol
LogP3.25
Rot. Bonds4

About 2-anilino-N-phenylprop-2-enamide

2-anilino-N-phenylprop-2-enamide (PubChem CID 20522355) has the molecular formula C15H14N2O and a molecular weight of 238.29 g/mol. Its IUPAC name is 2-anilino-N-phenylprop-2-enamide.

Molecular Properties

Compound Name2-anilino-N-phenylprop-2-enamide
PubChem CID20522355
Molecular FormulaC15H14N2O
Molecular Weight238.29 g/mol
Exact Mass238.11
IUPAC Name2-anilino-N-phenylprop-2-enamide
SMILESC=C(Nc1ccccc1)C(=O)Nc1ccccc1
InChIInChI=1S/C15H14N2O/c1-12(16-13-8-4-2-5-9-13)15(18)17-14-10-6-3-7-11-14/h2-11,16H,1H2,(H,17,18)
InChIKeyXGPACZAFBRDWDR-UHFFFAOYSA-N
XLogP3.25
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 53.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

4-methyl-2-methylidene-N-phenylpent-4-enamide
CID 53236011
N'-hydroxy-N-phenyloxamide
CID 5008441
potassium 2-anilino-2-oxoacetate
CID 23690423
methylboronic acid;2-methyl-N-phenylprop-2-enamide
CID 159528809
N-[4-[4-(4-anilinoanilino)anilino]phenyl]-2-methylprop-2-enamide
CID 102428329
1-N,1-N'-diphenylethene-1,1-diamine
CID 18406310
2-(4-dodecoxyanilino)-N-phenylprop-2-enamide;ethane
CID 91513037
(3-anilino-3-oxoprop-1-en-2-yl) dihydrogen phosphate
CID 13291526
4-anilino-3,4-dioxobutanoic acid
CID 67355795
2-methyl-N-phenylprop-2-enamide;styrene
CID 70398128
N,N',N'-triphenyloxamide
CID 54357836
cobalt;N-phenylacetamide
CID 158689050

Frequently Asked Questions

What is the IUPAC name of 2-anilino-N-phenylprop-2-enamide?
The IUPAC name of 2-anilino-N-phenylprop-2-enamide (CID 20522355) is 2-anilino-N-phenylprop-2-enamide.
What is the SMILES notation for 2-anilino-N-phenylprop-2-enamide?
The canonical SMILES for 2-anilino-N-phenylprop-2-enamide is C=C(Nc1ccccc1)C(=O)Nc1ccccc1.
What is the InChIKey of 2-anilino-N-phenylprop-2-enamide?
The InChIKey is XGPACZAFBRDWDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O/c1-12(16-13-8-4-2-5-9-13)15(18)17-14-10-6-3-7-11-14/h2-11,16H,1H2,(H,17,18).
What are the key properties of 2-anilino-N-phenylprop-2-enamide?
2-anilino-N-phenylprop-2-enamide has a molecular weight of 238.29 g/mol, XLogP of 3.25, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-anilino-N-phenylprop-2-enamide is sourced from PubChem (CID 20522355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).