2-diazo-N-methoxy-N-methyl-2-phenylacetamide

C10H11N3O2 — CID 122217607

IUPAC2-diazo-N-methoxy-N-methyl-2-phenylacetamide
SMILESCON(C)C(=O)C(=[N+]=[N-])c1ccccc1
InChIInChI=1S/C10H11N3O2/c1-13(15-2)10(14)9(12-11)8-6-4-3-5-7-8/h3-7H,1-2H3
InChIKeyKVZBDVHSXPBURT-UHFFFAOYSA-N
MW205.22 g/mol
LogP0.73
Rot. Bonds3

About 2-diazo-N-methoxy-N-methyl-2-phenylacetamide

2-diazo-N-methoxy-N-methyl-2-phenylacetamide (PubChem CID 122217607) has the molecular formula C10H11N3O2 and a molecular weight of 205.22 g/mol. Its IUPAC name is 2-diazo-N-methoxy-N-methyl-2-phenylacetamide.

Molecular Properties

Compound Name2-diazo-N-methoxy-N-methyl-2-phenylacetamide
PubChem CID122217607
Molecular FormulaC10H11N3O2
Molecular Weight205.22 g/mol
Exact Mass205.09
IUPAC Name2-diazo-N-methoxy-N-methyl-2-phenylacetamide
SMILESCON(C)C(=O)C(=[N+]=[N-])c1ccccc1
InChIInChI=1S/C10H11N3O2/c1-13(15-2)10(14)9(12-11)8-6-4-3-5-7-8/h3-7H,1-2H3
InChIKeyKVZBDVHSXPBURT-UHFFFAOYSA-N
XLogP0.73
TPSA65.94 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.22
LogP ≤ 50.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_3', 'substructure': 'N/A'}

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Related Compounds

2-diazo-N-methyl-N,2-diphenylacetamide
CID 57364283
2-diazo-2-(3,4-dichlorophenyl)-N-methoxy-N-methylacetamide
CID 86732607
1-diazo-1-phenylpropan-2-one
CID 72828466
methyl benzoate azide
CID 161139797
benzhydryl 2-diazo-2-phenylacetate
CID 102391609
(Z)-N-methoxy-N-methyl-3-phenylbut-2-enamide
CID 134920694
[3-(2-diazo-2-phenylacetyl)oxy-2,2-bis[(2-diazo-2-phenylacetyl)oxymethyl]propyl] 2-diazo-2-phenylacetate
CID 176825376
3-benzoyl-N-methoxy-N-methylbenzamide
CID 86595919
2-diazo-2-(3,4-dichlorophenyl)-N-methyl-N-phenylacetamide
CID 154710022
2-trimethylsilylethyl 2-diazo-2-phenylacetate
CID 132605238
N-methoxy-N-methyl-3-oxo-2,3-diphenylpropanamide
CID 166438028
(E)-N-methoxy-N-methyl-3-phenylpent-2-enamide
CID 135086786

Frequently Asked Questions

What is the IUPAC name of 2-diazo-N-methoxy-N-methyl-2-phenylacetamide?
The IUPAC name of 2-diazo-N-methoxy-N-methyl-2-phenylacetamide (CID 122217607) is 2-diazo-N-methoxy-N-methyl-2-phenylacetamide.
What is the SMILES notation for 2-diazo-N-methoxy-N-methyl-2-phenylacetamide?
The canonical SMILES for 2-diazo-N-methoxy-N-methyl-2-phenylacetamide is CON(C)C(=O)C(=[N+]=[N-])c1ccccc1.
What is the InChIKey of 2-diazo-N-methoxy-N-methyl-2-phenylacetamide?
The InChIKey is KVZBDVHSXPBURT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O2/c1-13(15-2)10(14)9(12-11)8-6-4-3-5-7-8/h3-7H,1-2H3.
What are the key properties of 2-diazo-N-methoxy-N-methyl-2-phenylacetamide?
2-diazo-N-methoxy-N-methyl-2-phenylacetamide has a molecular weight of 205.22 g/mol, XLogP of 0.73, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-diazo-N-methoxy-N-methyl-2-phenylacetamide is sourced from PubChem (CID 122217607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).