oxan-4-yl-(2,2,3,3-tetramethylcyclopropyl)methanol

C13H24O2 — CID 115797718

IUPACoxan-4-yl-(2,2,3,3-tetramethylcyclopropyl)methanol
SMILESCC1(C)C(C(O)C2CCOCC2)C1(C)C
InChIInChI=1S/C13H24O2/c1-12(2)11(13(12,3)4)10(14)9-5-7-15-8-6-9/h9-11,14H,5-8H2,1-4H3
InChIKeyYOIPTPGAKKMZMC-UHFFFAOYSA-N
MW212.33 g/mol
LogP2.46
Rot. Bonds2

About oxan-4-yl-(2,2,3,3-tetramethylcyclopropyl)methanol

oxan-4-yl-(2,2,3,3-tetramethylcyclopropyl)methanol (PubChem CID 115797718) has the molecular formula C13H24O2 and a molecular weight of 212.33 g/mol. Its IUPAC name is oxan-4-yl-(2,2,3,3-tetramethylcyclopropyl)methanol.

Molecular Properties

Compound Nameoxan-4-yl-(2,2,3,3-tetramethylcyclopropyl)methanol
PubChem CID115797718
Molecular FormulaC13H24O2
Molecular Weight212.33 g/mol
Exact Mass212.18
IUPAC Nameoxan-4-yl-(2,2,3,3-tetramethylcyclopropyl)methanol
SMILESCC1(C)C(C(O)C2CCOCC2)C1(C)C
InChIInChI=1S/C13H24O2/c1-12(2)11(13(12,3)4)10(14)9-5-7-15-8-6-9/h9-11,14H,5-8H2,1-4H3
InChIKeyYOIPTPGAKKMZMC-UHFFFAOYSA-N
XLogP2.46
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.33
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze oxan-4-yl-(2,2,3,3-tetramethylcyclopropyl)methanol 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

cyclopropyl(oxan-4-yl)methanol
CID 63936668
(2,2-dimethylcyclohexyl)-(oxan-4-yl)methanol
CID 107192269
oxan-4-yl(piperidin-4-yl)methanol;hydrochloride
CID 119031728
1-[hydroxy(oxan-4-yl)methyl]-4,4-dimethylcyclohexane-1-carbonitrile
CID 79132465
3,3-dimethyl-1-(oxan-4-yl)butan-1-ol
CID 63937877
dimethylamino(oxan-4-yl)methanol
CID 116909646
2-methyl-1-(oxan-4-yl)prop-2-en-1-ol
CID 79189800
1-amino-2-(oxan-4-yl)propan-1-ol
CID 88974259
(4-butylcyclohexyl)-(oxan-4-yl)methanol
CID 115797729
(2-methylthiolan-2-yl)-(oxan-4-yl)methanol
CID 105097535
(1S)-1-[(3R)-oxolan-3-yl]ethanol
CID 95763789
(4-methoxyoxan-4-yl)-(oxan-4-yl)methanol
CID 116753889

Frequently Asked Questions

What is the IUPAC name of oxan-4-yl-(2,2,3,3-tetramethylcyclopropyl)methanol?
The IUPAC name of oxan-4-yl-(2,2,3,3-tetramethylcyclopropyl)methanol (CID 115797718) is oxan-4-yl-(2,2,3,3-tetramethylcyclopropyl)methanol.
What is the SMILES notation for oxan-4-yl-(2,2,3,3-tetramethylcyclopropyl)methanol?
The canonical SMILES for oxan-4-yl-(2,2,3,3-tetramethylcyclopropyl)methanol is CC1(C)C(C(O)C2CCOCC2)C1(C)C.
What is the InChIKey of oxan-4-yl-(2,2,3,3-tetramethylcyclopropyl)methanol?
The InChIKey is YOIPTPGAKKMZMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24O2/c1-12(2)11(13(12,3)4)10(14)9-5-7-15-8-6-9/h9-11,14H,5-8H2,1-4H3.
What are the key properties of oxan-4-yl-(2,2,3,3-tetramethylcyclopropyl)methanol?
oxan-4-yl-(2,2,3,3-tetramethylcyclopropyl)methanol has a molecular weight of 212.33 g/mol, XLogP of 2.46, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for oxan-4-yl-(2,2,3,3-tetramethylcyclopropyl)methanol is sourced from PubChem (CID 115797718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).