(6aR,11bR)-7,11b-dihydro-6H-indeno[2,1-c]chromen-6a-ol

C16H14O2 — CID 166953593

IUPAC(6aR,11bR)-7,11b-dihydro-6H-indeno[2,1-c]chromen-6a-ol
SMILESO[C@@]12COc3ccccc3[C@H]1c1ccccc1C2
InChIInChI=1S/C16H14O2/c17-16-9-11-5-1-2-6-12(11)15(16)13-7-3-4-8-14(13)18-10-16/h1-8,15,17H,9-10H2/t15-,16+/m1/s1
InChIKeyLMKDYBABKPJWCB-CVEARBPZSA-N
MW238.29 g/mol
LogP2.50
Rot. Bonds

About (6aR,11bR)-7,11b-dihydro-6H-indeno[2,1-c]chromen-6a-ol

(6aR,11bR)-7,11b-dihydro-6H-indeno[2,1-c]chromen-6a-ol (PubChem CID 166953593) has the molecular formula C16H14O2 and a molecular weight of 238.29 g/mol. Its IUPAC name is (6aR,11bR)-7,11b-dihydro-6H-indeno[2,1-c]chromen-6a-ol.

Molecular Properties

Compound Name(6aR,11bR)-7,11b-dihydro-6H-indeno[2,1-c]chromen-6a-ol
PubChem CID166953593
Molecular FormulaC16H14O2
Molecular Weight238.29 g/mol
Exact Mass238.10
IUPAC Name(6aR,11bR)-7,11b-dihydro-6H-indeno[2,1-c]chromen-6a-ol
SMILESO[C@@]12COc3ccccc3[C@H]1c1ccccc1C2
InChIInChI=1S/C16H14O2/c17-16-9-11-5-1-2-6-12(11)15(16)13-7-3-4-8-14(13)18-10-16/h1-8,15,17H,9-10H2/t15-,16+/m1/s1
InChIKeyLMKDYBABKPJWCB-CVEARBPZSA-N
XLogP2.50
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (6aR,11bR)-7,11b-dihydro-6H-indeno[2,1-c]chromen-6a-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (6aR,11bR)-7,11b-dihydro-6H-indeno[2,1-c]chromen-6a-ol?
The IUPAC name of (6aR,11bR)-7,11b-dihydro-6H-indeno[2,1-c]chromen-6a-ol (CID 166953593) is (6aR,11bR)-7,11b-dihydro-6H-indeno[2,1-c]chromen-6a-ol.
What is the SMILES notation for (6aR,11bR)-7,11b-dihydro-6H-indeno[2,1-c]chromen-6a-ol?
The canonical SMILES for (6aR,11bR)-7,11b-dihydro-6H-indeno[2,1-c]chromen-6a-ol is O[C@@]12COc3ccccc3[C@H]1c1ccccc1C2.
What is the InChIKey of (6aR,11bR)-7,11b-dihydro-6H-indeno[2,1-c]chromen-6a-ol?
The InChIKey is LMKDYBABKPJWCB-CVEARBPZSA-N. The full InChI is InChI=1S/C16H14O2/c17-16-9-11-5-1-2-6-12(11)15(16)13-7-3-4-8-14(13)18-10-16/h1-8,15,17H,9-10H2/t15-,16+/m1/s1.
What are the key properties of (6aR,11bR)-7,11b-dihydro-6H-indeno[2,1-c]chromen-6a-ol?
(6aR,11bR)-7,11b-dihydro-6H-indeno[2,1-c]chromen-6a-ol has a molecular weight of 238.29 g/mol, XLogP of 2.50, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6aR,11bR)-7,11b-dihydro-6H-indeno[2,1-c]chromen-6a-ol is sourced from PubChem (CID 166953593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).