4a,10b-dihydrophenanthridin-4-ol

C13H11NO — CID 134427537

IUPAC4a,10b-dihydrophenanthridin-4-ol
SMILESOC1=CC=CC2c3ccccc3C=NC12
InChIInChI=1S/C13H11NO/c15-12-7-3-6-11-10-5-2-1-4-9(10)8-14-13(11)12/h1-8,11,13,15H
InChIKeyWHFFELKDFKKTAB-UHFFFAOYSA-N
MW197.24 g/mol
LogP2.58
Rot. Bonds

About 4a,10b-dihydrophenanthridin-4-ol

4a,10b-dihydrophenanthridin-4-ol (PubChem CID 134427537) has the molecular formula C13H11NO and a molecular weight of 197.24 g/mol. Its IUPAC name is 4a,10b-dihydrophenanthridin-4-ol.

Molecular Properties

Compound Name4a,10b-dihydrophenanthridin-4-ol
PubChem CID134427537
Molecular FormulaC13H11NO
Molecular Weight197.24 g/mol
Exact Mass197.08
IUPAC Name4a,10b-dihydrophenanthridin-4-ol
SMILESOC1=CC=CC2c3ccccc3C=NC12
InChIInChI=1S/C13H11NO/c15-12-7-3-6-11-10-5-2-1-4-9(10)8-14-13(11)12/h1-8,11,13,15H
InChIKeyWHFFELKDFKKTAB-UHFFFAOYSA-N
XLogP2.58
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.24
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4a,10b-dihydrophenanthridin-4-ol?
The IUPAC name of 4a,10b-dihydrophenanthridin-4-ol (CID 134427537) is 4a,10b-dihydrophenanthridin-4-ol.
What is the SMILES notation for 4a,10b-dihydrophenanthridin-4-ol?
The canonical SMILES for 4a,10b-dihydrophenanthridin-4-ol is OC1=CC=CC2c3ccccc3C=NC12.
What is the InChIKey of 4a,10b-dihydrophenanthridin-4-ol?
The InChIKey is WHFFELKDFKKTAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11NO/c15-12-7-3-6-11-10-5-2-1-4-9(10)8-14-13(11)12/h1-8,11,13,15H.
What are the key properties of 4a,10b-dihydrophenanthridin-4-ol?
4a,10b-dihydrophenanthridin-4-ol has a molecular weight of 197.24 g/mol, XLogP of 2.58, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4a,10b-dihydrophenanthridin-4-ol is sourced from PubChem (CID 134427537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).