N-(2-azidophenyl)-2,2-dimethylpropanamide

C11H14N4O — CID 151208886

IUPACN-(2-azidophenyl)-2,2-dimethylpropanamide
SMILESCC(C)(C)C(=O)Nc1ccccc1N=[N+]=[N-]
InChIInChI=1S/C11H14N4O/c1-11(2,3)10(16)13-8-6-4-5-7-9(8)14-15-12/h4-7H,1-3H3,(H,13,16)
InChIKeyNJVZTKPCGSDFKN-UHFFFAOYSA-N
MW218.26 g/mol
LogP3.61
Rot. Bonds2

About N-(2-azidophenyl)-2,2-dimethylpropanamide

N-(2-azidophenyl)-2,2-dimethylpropanamide (PubChem CID 151208886) has the molecular formula C11H14N4O and a molecular weight of 218.26 g/mol. Its IUPAC name is N-(2-azidophenyl)-2,2-dimethylpropanamide.

Molecular Properties

Compound NameN-(2-azidophenyl)-2,2-dimethylpropanamide
PubChem CID151208886
Molecular FormulaC11H14N4O
Molecular Weight218.26 g/mol
Exact Mass218.12
IUPAC NameN-(2-azidophenyl)-2,2-dimethylpropanamide
SMILESCC(C)(C)C(=O)Nc1ccccc1N=[N+]=[N-]
InChIInChI=1S/C11H14N4O/c1-11(2,3)10(16)13-8-6-4-5-7-9(8)14-15-12/h4-7H,1-3H3,(H,13,16)
InChIKeyNJVZTKPCGSDFKN-UHFFFAOYSA-N
XLogP3.61
TPSA77.86 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(2-azidophenyl)acetamide
CID 91902655
N-(2-azidophenyl)-2-methylpropanamide
CID 152547444
N-(2-azidophenyl)-2-bromoacetamide
CID 91902656
N-[2,3-bis(2,2-dimethylpropanoylamino)phenyl]-2,2-dimethylpropanamide
CID 141287633
2-azido-N-(2-ethylphenyl)benzamide
CID 169325145
methyl 2-(2,2-dimethylpropanoylamino)benzoate
CID 546733
2-azido-N-(2-azidobenzoyl)benzamide
CID 15319919
N-[2-(1-bromoethyl)phenyl]-2,2-dimethylpropanamide
CID 114315470
N-[2-(hydrazinecarbonyl)phenyl]-2,2-dimethylpropanamide
CID 117063512
N-anthracen-1-yl-2,2-dimethylpropanamide
CID 54051117
N-(5-hydroxynaphthalen-1-yl)-2,2-dimethylpropanamide
CID 64590909
N-(3-azido-2-methylphenyl)-2-methoxyacetamide
CID 169324993

Frequently Asked Questions

What is the IUPAC name of N-(2-azidophenyl)-2,2-dimethylpropanamide?
The IUPAC name of N-(2-azidophenyl)-2,2-dimethylpropanamide (CID 151208886) is N-(2-azidophenyl)-2,2-dimethylpropanamide.
What is the SMILES notation for N-(2-azidophenyl)-2,2-dimethylpropanamide?
The canonical SMILES for N-(2-azidophenyl)-2,2-dimethylpropanamide is CC(C)(C)C(=O)Nc1ccccc1N=[N+]=[N-].
What is the InChIKey of N-(2-azidophenyl)-2,2-dimethylpropanamide?
The InChIKey is NJVZTKPCGSDFKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O/c1-11(2,3)10(16)13-8-6-4-5-7-9(8)14-15-12/h4-7H,1-3H3,(H,13,16).
What are the key properties of N-(2-azidophenyl)-2,2-dimethylpropanamide?
N-(2-azidophenyl)-2,2-dimethylpropanamide has a molecular weight of 218.26 g/mol, XLogP of 3.61, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-azidophenyl)-2,2-dimethylpropanamide is sourced from PubChem (CID 151208886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).