8-methyl-2-propan-2-yl-4b,5,6,7,8,8a,9,10-octahydrophenanthren-3-ol

C18H26O — CID 143938277

IUPAC8-methyl-2-propan-2-yl-4b,5,6,7,8,8a,9,10-octahydrophenanthren-3-ol
SMILESCC(C)c1cc2c(cc1O)C1CCCC(C)C1CC2
InChIInChI=1S/C18H26O/c1-11(2)16-9-13-7-8-14-12(3)5-4-6-15(14)17(13)10-18(16)19/h9-12,14-15,19H,4-8H2,1-3H3
InChIKeyYEDITKAHHLOBJN-UHFFFAOYSA-N
MW258.40 g/mol
LogP4.98
Rot. Bonds1

About 8-methyl-2-propan-2-yl-4b,5,6,7,8,8a,9,10-octahydrophenanthren-3-ol

8-methyl-2-propan-2-yl-4b,5,6,7,8,8a,9,10-octahydrophenanthren-3-ol (PubChem CID 143938277) has the molecular formula C18H26O and a molecular weight of 258.40 g/mol. Its IUPAC name is 8-methyl-2-propan-2-yl-4b,5,6,7,8,8a,9,10-octahydrophenanthren-3-ol.

Molecular Properties

Compound Name8-methyl-2-propan-2-yl-4b,5,6,7,8,8a,9,10-octahydrophenanthren-3-ol
PubChem CID143938277
Molecular FormulaC18H26O
Molecular Weight258.40 g/mol
Exact Mass258.20
IUPAC Name8-methyl-2-propan-2-yl-4b,5,6,7,8,8a,9,10-octahydrophenanthren-3-ol
SMILESCC(C)c1cc2c(cc1O)C1CCCC(C)C1CC2
InChIInChI=1S/C18H26O/c1-11(2)16-9-13-7-8-14-12(3)5-4-6-15(14)17(13)10-18(16)19/h9-12,14-15,19H,4-8H2,1-3H3
InChIKeyYEDITKAHHLOBJN-UHFFFAOYSA-N
XLogP4.98
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.40
LogP ≤ 54.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 8-methyl-2-propan-2-yl-4b,5,6,7,8,8a,9,10-octahydrophenanthren-3-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 8-methyl-2-propan-2-yl-4b,5,6,7,8,8a,9,10-octahydrophenanthren-3-ol?
The IUPAC name of 8-methyl-2-propan-2-yl-4b,5,6,7,8,8a,9,10-octahydrophenanthren-3-ol (CID 143938277) is 8-methyl-2-propan-2-yl-4b,5,6,7,8,8a,9,10-octahydrophenanthren-3-ol.
What is the SMILES notation for 8-methyl-2-propan-2-yl-4b,5,6,7,8,8a,9,10-octahydrophenanthren-3-ol?
The canonical SMILES for 8-methyl-2-propan-2-yl-4b,5,6,7,8,8a,9,10-octahydrophenanthren-3-ol is CC(C)c1cc2c(cc1O)C1CCCC(C)C1CC2.
What is the InChIKey of 8-methyl-2-propan-2-yl-4b,5,6,7,8,8a,9,10-octahydrophenanthren-3-ol?
The InChIKey is YEDITKAHHLOBJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26O/c1-11(2)16-9-13-7-8-14-12(3)5-4-6-15(14)17(13)10-18(16)19/h9-12,14-15,19H,4-8H2,1-3H3.
What are the key properties of 8-methyl-2-propan-2-yl-4b,5,6,7,8,8a,9,10-octahydrophenanthren-3-ol?
8-methyl-2-propan-2-yl-4b,5,6,7,8,8a,9,10-octahydrophenanthren-3-ol has a molecular weight of 258.40 g/mol, XLogP of 4.98, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-2-propan-2-yl-4b,5,6,7,8,8a,9,10-octahydrophenanthren-3-ol is sourced from PubChem (CID 143938277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).