1-(5,6-dimethyl-7-oxabicyclo[2.2.1]heptan-2-yl)cyclohexan-1-ol

C14H24O2 — CID 20746701

IUPAC1-(5,6-dimethyl-7-oxabicyclo[2.2.1]heptan-2-yl)cyclohexan-1-ol
SMILESCC1C2CC(C3(O)CCCCC3)C(O2)C1C
InChIInChI=1S/C14H24O2/c1-9-10(2)13-11(8-12(9)16-13)14(15)6-4-3-5-7-14/h9-13,15H,3-8H2,1-2H3
InChIKeyGWGKVGQGUJMEAA-UHFFFAOYSA-N
MW224.34 g/mol
LogP2.74
Rot. Bonds1

About 1-(5,6-dimethyl-7-oxabicyclo[2.2.1]heptan-2-yl)cyclohexan-1-ol

1-(5,6-dimethyl-7-oxabicyclo[2.2.1]heptan-2-yl)cyclohexan-1-ol (PubChem CID 20746701) has the molecular formula C14H24O2 and a molecular weight of 224.34 g/mol. Its IUPAC name is 1-(5,6-dimethyl-7-oxabicyclo[2.2.1]heptan-2-yl)cyclohexan-1-ol.

Molecular Properties

Compound Name1-(5,6-dimethyl-7-oxabicyclo[2.2.1]heptan-2-yl)cyclohexan-1-ol
PubChem CID20746701
Molecular FormulaC14H24O2
Molecular Weight224.34 g/mol
Exact Mass224.18
IUPAC Name1-(5,6-dimethyl-7-oxabicyclo[2.2.1]heptan-2-yl)cyclohexan-1-ol
SMILESCC1C2CC(C3(O)CCCCC3)C(O2)C1C
InChIInChI=1S/C14H24O2/c1-9-10(2)13-11(8-12(9)16-13)14(15)6-4-3-5-7-14/h9-13,15H,3-8H2,1-2H3
InChIKeyGWGKVGQGUJMEAA-UHFFFAOYSA-N
XLogP2.74
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.34
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(5,6-dimethyl-7-oxabicyclo[2.2.1]heptan-2-yl)cyclohexan-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

2,3-dimethyl-5-(2-methyl-1,3-dithiolan-2-yl)-7-oxabicyclo[2.2.1]heptane
CID 58210266
(2R,3S,4R,5S,6S)-2-(1-hydroxycyclohexyl)-6-methyloxane-3,4,5-triol
CID 11831714
1-methyl-2,3,4,5,6,7,8,8a-octahydro-1H-isoquinolin-4a-ol;hydrochloride
CID 2969135
(5R,6S,9R,10R,15R,16S,20R,21S,24R,25R,30R,31S,34R,35R,36S,38R,39R,40S,42R,43R,44R,45R,46S,48R,49R)-5,15,20,30,36,40,46-heptaethyl-9,10,24,25,34,35,38,39,42,43,44,45,48,49-tetradecamethyl-2,4,7,12,14,17,19,22,27,29,32-undecaoxaoctacyclo[31.2.2.23,6.28,11.213,16.218,21.223,26.228,31]nonatetracontane
CID 90168302
(2S,3aR,7aR)-2-methyl-1,2,3,4,5,6,7,7a-octahydroinden-3a-ol
CID 101060141
1-[(1R,2S)-2-(methylamino)cyclohexyl]cyclopentan-1-ol
CID 138485486
1-[5-(1-hydroxycyclopentyl)-9,10-dimethyl-11,12-dioxatetracyclo[6.2.1.13,6.02,7]dodecan-4-yl]cyclopentan-1-ol;1-[5-(hydroxymethyl)-9,10-dimethyl-11,12-dioxatetracyclo[6.2.1.13,6.02,7]dodecan-4-yl]cyclopentan-1-ol;2-[5-(2-hydroxypropan-2-yl)-9,10-dimethyl-11,12-dioxatetracyclo[6.2.1.13,6.02,7]dodecan-4-yl]propan-2-ol;methane
CID 157293259
2-methyl-3-(2-methyl-7-oxabicyclo[4.1.0]heptan-3-yl)-7-oxabicyclo[4.1.0]heptane-3-carboxylic acid
CID 87226973
(8R,9S,10R,13R,14S)-13-methyl-2,3,4,6,7,8,9,10,11,12,14,15-dodecahydro-1H-cyclopenta[a]phenanthren-5-ol
CID 67724725
CID 160950059
CID 160950059
(1S,2S)-2-methyl-4,8-dioxatricyclo[4.2.1.03,7]nonan-5-one
CID 68649367
2,3-dimethyl-5-(3,3,3-trifluoro-2,2-dimethylpropyl)-7-oxabicyclo[2.2.1]heptane
CID 20770047

Frequently Asked Questions

What is the IUPAC name of 1-(5,6-dimethyl-7-oxabicyclo[2.2.1]heptan-2-yl)cyclohexan-1-ol?
The IUPAC name of 1-(5,6-dimethyl-7-oxabicyclo[2.2.1]heptan-2-yl)cyclohexan-1-ol (CID 20746701) is 1-(5,6-dimethyl-7-oxabicyclo[2.2.1]heptan-2-yl)cyclohexan-1-ol.
What is the SMILES notation for 1-(5,6-dimethyl-7-oxabicyclo[2.2.1]heptan-2-yl)cyclohexan-1-ol?
The canonical SMILES for 1-(5,6-dimethyl-7-oxabicyclo[2.2.1]heptan-2-yl)cyclohexan-1-ol is CC1C2CC(C3(O)CCCCC3)C(O2)C1C.
What is the InChIKey of 1-(5,6-dimethyl-7-oxabicyclo[2.2.1]heptan-2-yl)cyclohexan-1-ol?
The InChIKey is GWGKVGQGUJMEAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24O2/c1-9-10(2)13-11(8-12(9)16-13)14(15)6-4-3-5-7-14/h9-13,15H,3-8H2,1-2H3.
What are the key properties of 1-(5,6-dimethyl-7-oxabicyclo[2.2.1]heptan-2-yl)cyclohexan-1-ol?
1-(5,6-dimethyl-7-oxabicyclo[2.2.1]heptan-2-yl)cyclohexan-1-ol has a molecular weight of 224.34 g/mol, XLogP of 2.74, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5,6-dimethyl-7-oxabicyclo[2.2.1]heptan-2-yl)cyclohexan-1-ol is sourced from PubChem (CID 20746701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).