cyclopropyl(oxan-4-yl)methanol

C9H16O2 — CID 63936668

IUPACcyclopropyl(oxan-4-yl)methanol
SMILESOC(C1CCOCC1)C1CC1
InChIInChI=1S/C9H16O2/c10-9(7-1-2-7)8-3-5-11-6-4-8/h7-10H,1-6H2
InChIKeyQKXSNOLXVKJACK-UHFFFAOYSA-N
MW156.22 g/mol
LogP1.18
Rot. Bonds2

About cyclopropyl(oxan-4-yl)methanol

cyclopropyl(oxan-4-yl)methanol (PubChem CID 63936668) has the molecular formula C9H16O2 and a molecular weight of 156.22 g/mol. Its IUPAC name is cyclopropyl(oxan-4-yl)methanol.

Molecular Properties

Compound Namecyclopropyl(oxan-4-yl)methanol
PubChem CID63936668
Molecular FormulaC9H16O2
Molecular Weight156.22 g/mol
Exact Mass156.12
IUPAC Namecyclopropyl(oxan-4-yl)methanol
SMILESOC(C1CCOCC1)C1CC1
InChIInChI=1S/C9H16O2/c10-9(7-1-2-7)8-3-5-11-6-4-8/h7-10H,1-6H2
InChIKeyQKXSNOLXVKJACK-UHFFFAOYSA-N
XLogP1.18
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.22
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

oxan-4-yl(piperidin-4-yl)methanol;hydrochloride
CID 119031728
(4-butylcyclohexyl)-(oxan-4-yl)methanol
CID 115797729
oxan-4-yl-(2,2,3,3-tetramethylcyclopropyl)methanol
CID 115797718
(4-tert-butylcyclohexyl)-(oxolan-3-yl)methanol
CID 65400319
oxolan-3-yl(piperidin-4-yl)methanol
CID 80560253
cyclooctyl(cyclopropyl)methanol
CID 80603317
dimethylamino(oxan-4-yl)methanol
CID 116909646
(2,2-dimethylcyclohexyl)-(oxan-4-yl)methanol
CID 107192269
cyclopropyl(2,6-dioxaspiro[4.5]decan-9-yl)methanol
CID 79913944
2-methyl-1-(oxan-4-yl)prop-2-en-1-ol
CID 79189800
1-amino-2-(oxan-4-yl)propan-1-ol
CID 88974259
cyclopentyl(1,9-dioxaspiro[5.5]undecan-4-yl)methanol
CID 79913146

Frequently Asked Questions

What is the IUPAC name of cyclopropyl(oxan-4-yl)methanol?
The IUPAC name of cyclopropyl(oxan-4-yl)methanol (CID 63936668) is cyclopropyl(oxan-4-yl)methanol.
What is the SMILES notation for cyclopropyl(oxan-4-yl)methanol?
The canonical SMILES for cyclopropyl(oxan-4-yl)methanol is OC(C1CCOCC1)C1CC1.
What is the InChIKey of cyclopropyl(oxan-4-yl)methanol?
The InChIKey is QKXSNOLXVKJACK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16O2/c10-9(7-1-2-7)8-3-5-11-6-4-8/h7-10H,1-6H2.
What are the key properties of cyclopropyl(oxan-4-yl)methanol?
cyclopropyl(oxan-4-yl)methanol has a molecular weight of 156.22 g/mol, XLogP of 1.18, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropyl(oxan-4-yl)methanol is sourced from PubChem (CID 63936668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).