CID 11342105

C12H10N — CID 11342105

IUPAC—
SMILES[CH]1[CH][CH][C](/N=C/c2ccccc2)[CH]1
InChIInChI=1S/C12H10N/c1-2-6-11(7-3-1)10-13-12-8-4-5-9-12/h1-10H/b13-10+
InChIKeyCYCIOVCEJWEDGX-JLHYYAGUSA-N
MW168.22 g/mol
LogP2.47
Rot. Bonds2

About CID 11342105

CID 11342105 (PubChem CID 11342105) has the molecular formula C12H10N and a molecular weight of 168.22 g/mol.

Molecular Properties

Compound NameCID 11342105
PubChem CID11342105
Molecular FormulaC12H10N
Molecular Weight168.22 g/mol
Exact Mass168.08
IUPAC Name—
SMILES[CH]1[CH][CH][C](/N=C/c2ccccc2)[CH]1
InChIInChI=1S/C12H10N/c1-2-6-11(7-3-1)10-13-12-8-4-5-9-12/h1-10H/b13-10+
InChIKeyCYCIOVCEJWEDGX-JLHYYAGUSA-N
XLogP2.47
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.22
LogP ≤ 52.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of CID 11342105?
The IUPAC name of CID 11342105 (CID 11342105) is not available.
What is the SMILES notation for CID 11342105?
The canonical SMILES for CID 11342105 is [CH]1[CH][CH][C](/N=C/c2ccccc2)[CH]1.
What is the InChIKey of CID 11342105?
The InChIKey is CYCIOVCEJWEDGX-JLHYYAGUSA-N. The full InChI is InChI=1S/C12H10N/c1-2-6-11(7-3-1)10-13-12-8-4-5-9-12/h1-10H/b13-10+.
What are the key properties of CID 11342105?
CID 11342105 has a molecular weight of 168.22 g/mol, XLogP of 2.47, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 11342105 is sourced from PubChem (CID 11342105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).