2-amino-N-[amino(phenyl)methylidene]-2-phenylacetamide

C15H15N3O — CID 121264672

IUPAC2-amino-N-[amino(phenyl)methylidene]-2-phenylacetamide
SMILESN/C(=N\C(=O)C(N)c1ccccc1)c1ccccc1
InChIInChI=1S/C15H15N3O/c16-13(11-7-3-1-4-8-11)15(19)18-14(17)12-9-5-2-6-10-12/h1-10,13H,16H2,(H2,17,18,19)
InChIKeyBCCIFNQHSFWDAX-UHFFFAOYSA-N
MW253.31 g/mol
LogP1.62
Rot. Bonds3

About 2-amino-N-[amino(phenyl)methylidene]-2-phenylacetamide

2-amino-N-[amino(phenyl)methylidene]-2-phenylacetamide (PubChem CID 121264672) has the molecular formula C15H15N3O and a molecular weight of 253.31 g/mol. Its IUPAC name is 2-amino-N-[amino(phenyl)methylidene]-2-phenylacetamide.

Molecular Properties

Compound Name2-amino-N-[amino(phenyl)methylidene]-2-phenylacetamide
PubChem CID121264672
Molecular FormulaC15H15N3O
Molecular Weight253.31 g/mol
Exact Mass253.12
IUPAC Name2-amino-N-[amino(phenyl)methylidene]-2-phenylacetamide
SMILESN/C(=N\C(=O)C(N)c1ccccc1)c1ccccc1
InChIInChI=1S/C15H15N3O/c16-13(11-7-3-1-4-8-11)15(19)18-14(17)12-9-5-2-6-10-12/h1-10,13H,16H2,(H2,17,18,19)
InChIKeyBCCIFNQHSFWDAX-UHFFFAOYSA-N
XLogP1.62
TPSA81.47 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.31
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

[amino(phenyl)methylidene]carbamic acid
CID 54409873
2-amino-2-phenylacetic acid;carbamic acid
CID 159174170
N-[2-[[amino(phenyl)methylidene]amino]-2-oxo-1-phenylethyl]-4-chlorobenzamide
CID 121264156
(2R)-2-amino-2-((1,2,3,4,5,6-13C6)cyclohexatrienyl)acetic acid
CID 71309299
2-amino-2-phenylacetic acid;benzene
CID 18446848
CID 172809734
CID 172809734
N'-aminobenzenecarboximidamide
CID 5474957
sodium;(2S)-2-amino-2-phenylacetic acid;carbanide
CID 175955614
(2S)-2-amino-N,N-dimethyl-2-phenylacetamide
CID 11263835
benzoic acid;diphenylmethanamine
CID 3075109
2-amino-2-phenylacetyl chloride;hydron;chloride
CID 51056098
N'-hydroxybenzenecarboximidamide
CID 142861747

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[amino(phenyl)methylidene]-2-phenylacetamide?
The IUPAC name of 2-amino-N-[amino(phenyl)methylidene]-2-phenylacetamide (CID 121264672) is 2-amino-N-[amino(phenyl)methylidene]-2-phenylacetamide.
What is the SMILES notation for 2-amino-N-[amino(phenyl)methylidene]-2-phenylacetamide?
The canonical SMILES for 2-amino-N-[amino(phenyl)methylidene]-2-phenylacetamide is N/C(=N\C(=O)C(N)c1ccccc1)c1ccccc1.
What is the InChIKey of 2-amino-N-[amino(phenyl)methylidene]-2-phenylacetamide?
The InChIKey is BCCIFNQHSFWDAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O/c16-13(11-7-3-1-4-8-11)15(19)18-14(17)12-9-5-2-6-10-12/h1-10,13H,16H2,(H2,17,18,19).
What are the key properties of 2-amino-N-[amino(phenyl)methylidene]-2-phenylacetamide?
2-amino-N-[amino(phenyl)methylidene]-2-phenylacetamide has a molecular weight of 253.31 g/mol, XLogP of 1.62, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[amino(phenyl)methylidene]-2-phenylacetamide is sourced from PubChem (CID 121264672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).