5,6-dihydro-1,7-phenanthroline

C12H10N2 — CID 69016308

IUPAC5,6-dihydro-1,7-phenanthroline
SMILESc1cnc2c(c1)CCc1ncccc1-2
InChIInChI=1S/C12H10N2/c1-3-9-5-6-11-10(4-2-7-13-11)12(9)14-8-1/h1-4,7-8H,5-6H2
InChIKeyJTEBTOAYDVITQS-UHFFFAOYSA-N
MW182.23 g/mol
LogP2.24
Rot. Bonds

About 5,6-dihydro-1,7-phenanthroline

5,6-dihydro-1,7-phenanthroline (PubChem CID 69016308) has the molecular formula C12H10N2 and a molecular weight of 182.23 g/mol. Its IUPAC name is 5,6-dihydro-1,7-phenanthroline.

Molecular Properties

Compound Name5,6-dihydro-1,7-phenanthroline
PubChem CID69016308
Molecular FormulaC12H10N2
Molecular Weight182.23 g/mol
Exact Mass182.08
IUPAC Name5,6-dihydro-1,7-phenanthroline
SMILESc1cnc2c(c1)CCc1ncccc1-2
InChIInChI=1S/C12H10N2/c1-3-9-5-6-11-10(4-2-7-13-11)12(9)14-8-1/h1-4,7-8H,5-6H2
InChIKeyJTEBTOAYDVITQS-UHFFFAOYSA-N
XLogP2.24
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.23
LogP ≤ 52.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5,6-dihydro-1,7-phenanthroline?
The IUPAC name of 5,6-dihydro-1,7-phenanthroline (CID 69016308) is 5,6-dihydro-1,7-phenanthroline.
What is the SMILES notation for 5,6-dihydro-1,7-phenanthroline?
The canonical SMILES for 5,6-dihydro-1,7-phenanthroline is c1cnc2c(c1)CCc1ncccc1-2.
What is the InChIKey of 5,6-dihydro-1,7-phenanthroline?
The InChIKey is JTEBTOAYDVITQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10N2/c1-3-9-5-6-11-10(4-2-7-13-11)12(9)14-8-1/h1-4,7-8H,5-6H2.
What are the key properties of 5,6-dihydro-1,7-phenanthroline?
5,6-dihydro-1,7-phenanthroline has a molecular weight of 182.23 g/mol, XLogP of 2.24, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-dihydro-1,7-phenanthroline is sourced from PubChem (CID 69016308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).