1-[(2-azidophenyl)methyl]-2-phenylhydrazine

C13H13N5 — CID 169386568

IUPAC1-[(2-azidophenyl)methyl]-2-phenylhydrazine
SMILES[N-]=[N+]=Nc1ccccc1CNNc1ccccc1
InChIInChI=1S/C13H13N5/c14-18-17-13-9-5-4-6-11(13)10-15-16-12-7-2-1-3-8-12/h1-9,15-16H,10H2
InChIKeyYGQHBHVRMXGRNO-UHFFFAOYSA-N
MW239.28 g/mol
LogP3.75
Rot. Bonds5

About 1-[(2-azidophenyl)methyl]-2-phenylhydrazine

1-[(2-azidophenyl)methyl]-2-phenylhydrazine (PubChem CID 169386568) has the molecular formula C13H13N5 and a molecular weight of 239.28 g/mol. Its IUPAC name is 1-[(2-azidophenyl)methyl]-2-phenylhydrazine.

Molecular Properties

Compound Name1-[(2-azidophenyl)methyl]-2-phenylhydrazine
PubChem CID169386568
Molecular FormulaC13H13N5
Molecular Weight239.28 g/mol
Exact Mass239.12
IUPAC Name1-[(2-azidophenyl)methyl]-2-phenylhydrazine
SMILES[N-]=[N+]=Nc1ccccc1CNNc1ccccc1
InChIInChI=1S/C13H13N5/c14-18-17-13-9-5-4-6-11(13)10-15-16-12-7-2-1-3-8-12/h1-9,15-16H,10H2
InChIKeyYGQHBHVRMXGRNO-UHFFFAOYSA-N
XLogP3.75
TPSA72.82 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.28
LogP ≤ 53.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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

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Related Compounds

(2-azidophenyl)methanamine
CID 10997194
1-azido-2-(2-phenylethyl)benzene
CID 10059466
3-[(2-phenylhydrazinyl)methyl]benzene-1,2-diol
CID 169384433
2-[(2-azidophenyl)methyl]benzotriazole
CID 45103967
1-[[2-(benzenesulfonyl)phenyl]methyl]-2-phenylhydrazine
CID 169385347
1-[(2,3-dimethylphenyl)methyl]-2-phenylhydrazine
CID 169384408
1-[(2,3-difluorophenyl)methyl]-2-phenylhydrazine
CID 169384437
4-(2-azidophenyl)butylcarbamic acid
CID 121416300
4-[(2-azidophenyl)methyl]morpholine
CID 151936808
3-(2-azidophenyl)-N-ethylpropan-1-amine
CID 11790330
1-phenyl-2-[[2-(2-phenylethoxy)phenyl]methyl]hydrazine
CID 169385834
2-[(2-phenylhydrazinyl)methyl]benzenesulfonic acid
CID 169384301

Frequently Asked Questions

What is the IUPAC name of 1-[(2-azidophenyl)methyl]-2-phenylhydrazine?
The IUPAC name of 1-[(2-azidophenyl)methyl]-2-phenylhydrazine (CID 169386568) is 1-[(2-azidophenyl)methyl]-2-phenylhydrazine.
What is the SMILES notation for 1-[(2-azidophenyl)methyl]-2-phenylhydrazine?
The canonical SMILES for 1-[(2-azidophenyl)methyl]-2-phenylhydrazine is [N-]=[N+]=Nc1ccccc1CNNc1ccccc1.
What is the InChIKey of 1-[(2-azidophenyl)methyl]-2-phenylhydrazine?
The InChIKey is YGQHBHVRMXGRNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N5/c14-18-17-13-9-5-4-6-11(13)10-15-16-12-7-2-1-3-8-12/h1-9,15-16H,10H2.
What are the key properties of 1-[(2-azidophenyl)methyl]-2-phenylhydrazine?
1-[(2-azidophenyl)methyl]-2-phenylhydrazine has a molecular weight of 239.28 g/mol, XLogP of 3.75, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-azidophenyl)methyl]-2-phenylhydrazine is sourced from PubChem (CID 169386568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).