2-phenylimidazo[1,2-f]phenanthridin-11-ol

C21H14N2O — CID 163435365

IUPAC2-phenylimidazo[1,2-f]phenanthridin-11-ol
SMILESOc1ccc2c3ccccc3n3cc(-c4ccccc4)nc3c2c1
InChIInChI=1S/C21H14N2O/c24-15-10-11-16-17-8-4-5-9-20(17)23-13-19(14-6-2-1-3-7-14)22-21(23)18(16)12-15/h1-13,24H
InChIKeyRROWYRJRKOFERE-UHFFFAOYSA-N
MW310.36 g/mol
LogP5.01
Rot. Bonds1

About 2-phenylimidazo[1,2-f]phenanthridin-11-ol

2-phenylimidazo[1,2-f]phenanthridin-11-ol (PubChem CID 163435365) has the molecular formula C21H14N2O and a molecular weight of 310.36 g/mol. Its IUPAC name is 2-phenylimidazo[1,2-f]phenanthridin-11-ol.

Molecular Properties

Compound Name2-phenylimidazo[1,2-f]phenanthridin-11-ol
PubChem CID163435365
Molecular FormulaC21H14N2O
Molecular Weight310.36 g/mol
Exact Mass310.11
IUPAC Name2-phenylimidazo[1,2-f]phenanthridin-11-ol
SMILESOc1ccc2c3ccccc3n3cc(-c4ccccc4)nc3c2c1
InChIInChI=1S/C21H14N2O/c24-15-10-11-16-17-8-4-5-9-20(17)23-13-19(14-6-2-1-3-7-14)22-21(23)18(16)12-15/h1-13,24H
InChIKeyRROWYRJRKOFERE-UHFFFAOYSA-N
XLogP5.01
TPSA37.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms24
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500310.36
LogP ≤ 55.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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 2-phenylimidazo[1,2-f]phenanthridin-11-ol?
The IUPAC name of 2-phenylimidazo[1,2-f]phenanthridin-11-ol (CID 163435365) is 2-phenylimidazo[1,2-f]phenanthridin-11-ol.
What is the SMILES notation for 2-phenylimidazo[1,2-f]phenanthridin-11-ol?
The canonical SMILES for 2-phenylimidazo[1,2-f]phenanthridin-11-ol is Oc1ccc2c3ccccc3n3cc(-c4ccccc4)nc3c2c1.
What is the InChIKey of 2-phenylimidazo[1,2-f]phenanthridin-11-ol?
The InChIKey is RROWYRJRKOFERE-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H14N2O/c24-15-10-11-16-17-8-4-5-9-20(17)23-13-19(14-6-2-1-3-7-14)22-21(23)18(16)12-15/h1-13,24H.
What are the key properties of 2-phenylimidazo[1,2-f]phenanthridin-11-ol?
2-phenylimidazo[1,2-f]phenanthridin-11-ol has a molecular weight of 310.36 g/mol, XLogP of 5.01, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenylimidazo[1,2-f]phenanthridin-11-ol is sourced from PubChem (CID 163435365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).