3-(3-tricyclo[3.3.1.03,7]nonanyl)propan-1-ol

C12H20O — CID 130130448

IUPAC3-(3-tricyclo[3.3.1.03,7]nonanyl)propan-1-ol
SMILESOCCCC12CC3CC(CC1C3)C2
InChIInChI=1S/C12H20O/c13-3-1-2-12-7-9-4-10(8-12)6-11(12)5-9/h9-11,13H,1-8H2
InChIKeyRDPNCKBOKQPZFO-UHFFFAOYSA-N
MW180.29 g/mol
LogP2.59
Rot. Bonds3

About 3-(3-tricyclo[3.3.1.03,7]nonanyl)propan-1-ol

3-(3-tricyclo[3.3.1.03,7]nonanyl)propan-1-ol (PubChem CID 130130448) has the molecular formula C12H20O and a molecular weight of 180.29 g/mol. Its IUPAC name is 3-(3-tricyclo[3.3.1.03,7]nonanyl)propan-1-ol.

Molecular Properties

Compound Name3-(3-tricyclo[3.3.1.03,7]nonanyl)propan-1-ol
PubChem CID130130448
Molecular FormulaC12H20O
Molecular Weight180.29 g/mol
Exact Mass180.15
IUPAC Name3-(3-tricyclo[3.3.1.03,7]nonanyl)propan-1-ol
SMILESOCCCC12CC3CC(CC1C3)C2
InChIInChI=1S/C12H20O/c13-3-1-2-12-7-9-4-10(8-12)6-11(12)5-9/h9-11,13H,1-8H2
InChIKeyRDPNCKBOKQPZFO-UHFFFAOYSA-N
XLogP2.59
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.29
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 3-(3-tricyclo[3.3.1.03,7]nonanyl)propan-1-ol with MolForge

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

Launch Full Analysis

Related Compounds

1-(3-hydroxypropyl)adamantan-2-ol
CID 73302392
2-(3-hydroxypropyl)adamantan-2-ol
CID 14913337
3-(2-methyl-2-bicyclo[2.2.1]heptanyl)propan-1-ol
CID 168807164
3-(1-bicyclo[3.1.0]hexanyl)propan-1-ol
CID 90022517
3-[2-(1-adamantyl)ethylsulfanyl]propan-1-ol
CID 66113859
3-[2-(1-adamantyl)ethyl-methylamino]propan-1-ol
CID 114230783
(2S,5S,7S)-1-(hydroxymethyl)adamantan-2-ol
CID 124583912
(5S,7R)-1-(hydroxymethyl)adamantan-2-ol
CID 102508156
N,N-bis(2-hydroxyethyl)adamantane-1-carboxamide
CID 60653107
1-(3-hydroxypropyl)-2-methylcyclopropan-1-ol
CID 54261180
3-[1-adamantyl(methyl)amino]propan-1-ol;hydrochloride
CID 2865633
(1S,2S,4S)-2-(2-hydroxyethyl)bicyclo[2.2.1]heptan-2-ol
CID 130877530

Frequently Asked Questions

What is the IUPAC name of 3-(3-tricyclo[3.3.1.03,7]nonanyl)propan-1-ol?
The IUPAC name of 3-(3-tricyclo[3.3.1.03,7]nonanyl)propan-1-ol (CID 130130448) is 3-(3-tricyclo[3.3.1.03,7]nonanyl)propan-1-ol.
What is the SMILES notation for 3-(3-tricyclo[3.3.1.03,7]nonanyl)propan-1-ol?
The canonical SMILES for 3-(3-tricyclo[3.3.1.03,7]nonanyl)propan-1-ol is OCCCC12CC3CC(CC1C3)C2.
What is the InChIKey of 3-(3-tricyclo[3.3.1.03,7]nonanyl)propan-1-ol?
The InChIKey is RDPNCKBOKQPZFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20O/c13-3-1-2-12-7-9-4-10(8-12)6-11(12)5-9/h9-11,13H,1-8H2.
What are the key properties of 3-(3-tricyclo[3.3.1.03,7]nonanyl)propan-1-ol?
3-(3-tricyclo[3.3.1.03,7]nonanyl)propan-1-ol has a molecular weight of 180.29 g/mol, XLogP of 2.59, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-tricyclo[3.3.1.03,7]nonanyl)propan-1-ol is sourced from PubChem (CID 130130448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).