CID 134935928

C11H9N2 — CID 134935928

IUPAC—
SMILES[CH]1[CH][CH][C](/N=N/c2ccccc2)[CH]1
InChIInChI=1S/C11H9N2/c1-2-6-10(7-3-1)12-13-11-8-4-5-9-11/h1-9H/b13-12+
InChIKeyOEBKFBSCWMSNOH-OUKQBFOZSA-N
MW169.21 g/mol
LogP3.13
Rot. Bonds2

About CID 134935928

CID 134935928 (PubChem CID 134935928) has the molecular formula C11H9N2 and a molecular weight of 169.21 g/mol.

Molecular Properties

Compound NameCID 134935928
PubChem CID134935928
Molecular FormulaC11H9N2
Molecular Weight169.21 g/mol
Exact Mass169.08
IUPAC Name—
SMILES[CH]1[CH][CH][C](/N=N/c2ccccc2)[CH]1
InChIInChI=1S/C11H9N2/c1-2-6-10(7-3-1)12-13-11-8-4-5-9-11/h1-9H/b13-12+
InChIKeyOEBKFBSCWMSNOH-OUKQBFOZSA-N
XLogP3.13
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.21
LogP ≤ 53.13
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'}

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Frequently Asked Questions

What is the IUPAC name of CID 134935928?
The IUPAC name of CID 134935928 (CID 134935928) is not available.
What is the SMILES notation for CID 134935928?
The canonical SMILES for CID 134935928 is [CH]1[CH][CH][C](/N=N/c2ccccc2)[CH]1.
What is the InChIKey of CID 134935928?
The InChIKey is OEBKFBSCWMSNOH-OUKQBFOZSA-N. The full InChI is InChI=1S/C11H9N2/c1-2-6-10(7-3-1)12-13-11-8-4-5-9-11/h1-9H/b13-12+.
What are the key properties of CID 134935928?
CID 134935928 has a molecular weight of 169.21 g/mol, XLogP of 3.13, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 134935928 is sourced from PubChem (CID 134935928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).