12-methylimidazo[1,2-f]phenanthridine

C16H12N2 — CID 67953611

IUPAC12-methylimidazo[1,2-f]phenanthridine
SMILESCc1cccc2c3ccccc3n3ccnc3c12
InChIInChI=1S/C16H12N2/c1-11-5-4-7-13-12-6-2-3-8-14(12)18-10-9-17-16(18)15(11)13/h2-10H,1H3
InChIKeyUBTAAZJAYMHZFL-UHFFFAOYSA-N
MW232.29 g/mol
LogP3.95
Rot. Bonds

About 12-methylimidazo[1,2-f]phenanthridine

12-methylimidazo[1,2-f]phenanthridine (PubChem CID 67953611) has the molecular formula C16H12N2 and a molecular weight of 232.29 g/mol. Its IUPAC name is 12-methylimidazo[1,2-f]phenanthridine.

Molecular Properties

Compound Name12-methylimidazo[1,2-f]phenanthridine
PubChem CID67953611
Molecular FormulaC16H12N2
Molecular Weight232.29 g/mol
Exact Mass232.10
IUPAC Name12-methylimidazo[1,2-f]phenanthridine
SMILESCc1cccc2c3ccccc3n3ccnc3c12
InChIInChI=1S/C16H12N2/c1-11-5-4-7-13-12-6-2-3-8-14(12)18-10-9-17-16(18)15(11)13/h2-10H,1H3
InChIKeyUBTAAZJAYMHZFL-UHFFFAOYSA-N
XLogP3.95
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.29
LogP ≤ 53.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 12-methylimidazo[1,2-f]phenanthridine?
The IUPAC name of 12-methylimidazo[1,2-f]phenanthridine (CID 67953611) is 12-methylimidazo[1,2-f]phenanthridine.
What is the SMILES notation for 12-methylimidazo[1,2-f]phenanthridine?
The canonical SMILES for 12-methylimidazo[1,2-f]phenanthridine is Cc1cccc2c3ccccc3n3ccnc3c12.
What is the InChIKey of 12-methylimidazo[1,2-f]phenanthridine?
The InChIKey is UBTAAZJAYMHZFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12N2/c1-11-5-4-7-13-12-6-2-3-8-14(12)18-10-9-17-16(18)15(11)13/h2-10H,1H3.
What are the key properties of 12-methylimidazo[1,2-f]phenanthridine?
12-methylimidazo[1,2-f]phenanthridine has a molecular weight of 232.29 g/mol, XLogP of 3.95, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 12-methylimidazo[1,2-f]phenanthridine is sourced from PubChem (CID 67953611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).