1-naphthalen-2-ylethenyldiazene

C12H10N2 — CID 163644367

IUPAC1-naphthalen-2-ylethenyldiazene
SMILES[H]/N=N/C(=C)c1ccc2ccccc2c1
InChIInChI=1S/C12H10N2/c1-9(14-13)11-7-6-10-4-2-3-5-12(10)8-11/h2-8,13H,1H2/b14-13+
InChIKeyIGYZUCJNVSHVEP-BUHFOSPRSA-N
MW182.23 g/mol
LogP3.84
Rot. Bonds2

About 1-naphthalen-2-ylethenyldiazene

1-naphthalen-2-ylethenyldiazene (PubChem CID 163644367) has the molecular formula C12H10N2 and a molecular weight of 182.23 g/mol. Its IUPAC name is 1-naphthalen-2-ylethenyldiazene.

Molecular Properties

Compound Name1-naphthalen-2-ylethenyldiazene
PubChem CID163644367
Molecular FormulaC12H10N2
Molecular Weight182.23 g/mol
Exact Mass182.08
IUPAC Name1-naphthalen-2-ylethenyldiazene
SMILES[H]/N=N/C(=C)c1ccc2ccccc2c1
InChIInChI=1S/C12H10N2/c1-9(14-13)11-7-6-10-4-2-3-5-12(10)8-11/h2-8,13H,1H2/b14-13+
InChIKeyIGYZUCJNVSHVEP-BUHFOSPRSA-N
XLogP3.84
TPSA36.21 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.23
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-naphthalen-2-ylethenyldiazene?
The IUPAC name of 1-naphthalen-2-ylethenyldiazene (CID 163644367) is 1-naphthalen-2-ylethenyldiazene.
What is the SMILES notation for 1-naphthalen-2-ylethenyldiazene?
The canonical SMILES for 1-naphthalen-2-ylethenyldiazene is [H]/N=N/C(=C)c1ccc2ccccc2c1.
What is the InChIKey of 1-naphthalen-2-ylethenyldiazene?
The InChIKey is IGYZUCJNVSHVEP-BUHFOSPRSA-N. The full InChI is InChI=1S/C12H10N2/c1-9(14-13)11-7-6-10-4-2-3-5-12(10)8-11/h2-8,13H,1H2/b14-13+.
What are the key properties of 1-naphthalen-2-ylethenyldiazene?
1-naphthalen-2-ylethenyldiazene has a molecular weight of 182.23 g/mol, XLogP of 3.84, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-naphthalen-2-ylethenyldiazene is sourced from PubChem (CID 163644367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).