2-diazo-N-methyl-N,2-diphenylacetamide

C15H13N3O — CID 57364283

IUPAC2-diazo-N-methyl-N,2-diphenylacetamide
SMILESCN(C(=O)C(=[N+]=[N-])c1ccccc1)c1ccccc1
InChIInChI=1S/C15H13N3O/c1-18(13-10-6-3-7-11-13)15(19)14(17-16)12-8-4-2-5-9-12/h2-11H,1H3
InChIKeyNLIADWGWATWJCY-UHFFFAOYSA-N
MW251.29 g/mol
LogP2.37
Rot. Bonds3

About 2-diazo-N-methyl-N,2-diphenylacetamide

2-diazo-N-methyl-N,2-diphenylacetamide (PubChem CID 57364283) has the molecular formula C15H13N3O and a molecular weight of 251.29 g/mol. Its IUPAC name is 2-diazo-N-methyl-N,2-diphenylacetamide.

Molecular Properties

Compound Name2-diazo-N-methyl-N,2-diphenylacetamide
PubChem CID57364283
Molecular FormulaC15H13N3O
Molecular Weight251.29 g/mol
Exact Mass251.11
IUPAC Name2-diazo-N-methyl-N,2-diphenylacetamide
SMILESCN(C(=O)C(=[N+]=[N-])c1ccccc1)c1ccccc1
InChIInChI=1S/C15H13N3O/c1-18(13-10-6-3-7-11-13)15(19)14(17-16)12-8-4-2-5-9-12/h2-11H,1H3
InChIKeyNLIADWGWATWJCY-UHFFFAOYSA-N
XLogP2.37
TPSA56.71 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.29
LogP ≤ 52.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_3', 'substructure': 'N/A'}

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Related Compounds

2-diazo-2-(3,4-dichlorophenyl)-N-methyl-N-phenylacetamide
CID 154710022
2-diazo-N-methoxy-N-methyl-2-phenylacetamide
CID 122217607
1-diazo-1-phenylpropan-2-one
CID 72828466
(E)-N,2-dimethyl-N-phenylbut-2-enamide
CID 10867125
1,3-dimethyl-1-phenyl-3-sulfanylurea
CID 88793984
N,3-dimethyl-2-methylidene-N-phenylbut-3-enamide
CID 89087492
2-(4-chlorophenyl)-N-methyl-2-oxo-N-phenylacetamide
CID 13109495
3-hydroxy-N,4,4-trimethyl-2-methylidene-N-phenylpentanamide
CID 15519221
N-methyl-N-phenylpyridine-3-carboxamide;hydrochloride
CID 110756365
benzoic acid;N-methyl-N-phenylaniline
CID 158055475
(E)-N-methyl-N,3-diphenylbut-2-enamide
CID 11032331
N-benzyl-N,N'-dimethyl-N'-phenyloxamide
CID 108518736

Frequently Asked Questions

What is the IUPAC name of 2-diazo-N-methyl-N,2-diphenylacetamide?
The IUPAC name of 2-diazo-N-methyl-N,2-diphenylacetamide (CID 57364283) is 2-diazo-N-methyl-N,2-diphenylacetamide.
What is the SMILES notation for 2-diazo-N-methyl-N,2-diphenylacetamide?
The canonical SMILES for 2-diazo-N-methyl-N,2-diphenylacetamide is CN(C(=O)C(=[N+]=[N-])c1ccccc1)c1ccccc1.
What is the InChIKey of 2-diazo-N-methyl-N,2-diphenylacetamide?
The InChIKey is NLIADWGWATWJCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O/c1-18(13-10-6-3-7-11-13)15(19)14(17-16)12-8-4-2-5-9-12/h2-11H,1H3.
What are the key properties of 2-diazo-N-methyl-N,2-diphenylacetamide?
2-diazo-N-methyl-N,2-diphenylacetamide has a molecular weight of 251.29 g/mol, XLogP of 2.37, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-diazo-N-methyl-N,2-diphenylacetamide is sourced from PubChem (CID 57364283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).