[2-(2-methoxypropan-2-yl)oxan-3-yl]methanol

C10H20O3 — CID 131115463

IUPAC[2-(2-methoxypropan-2-yl)oxan-3-yl]methanol
SMILESCOC(C)(C)C1OCCCC1CO
InChIInChI=1S/C10H20O3/c1-10(2,12-3)9-8(7-11)5-4-6-13-9/h8-9,11H,4-7H2,1-3H3
InChIKeyQRXSQTOKOOYPFP-UHFFFAOYSA-N
MW188.27 g/mol
LogP1.20
Rot. Bonds3

About [2-(2-methoxypropan-2-yl)oxan-3-yl]methanol

[2-(2-methoxypropan-2-yl)oxan-3-yl]methanol (PubChem CID 131115463) has the molecular formula C10H20O3 and a molecular weight of 188.27 g/mol. Its IUPAC name is [2-(2-methoxypropan-2-yl)oxan-3-yl]methanol.

Molecular Properties

Compound Name[2-(2-methoxypropan-2-yl)oxan-3-yl]methanol
PubChem CID131115463
Molecular FormulaC10H20O3
Molecular Weight188.27 g/mol
Exact Mass188.14
IUPAC Name[2-(2-methoxypropan-2-yl)oxan-3-yl]methanol
SMILESCOC(C)(C)C1OCCCC1CO
InChIInChI=1S/C10H20O3/c1-10(2,12-3)9-8(7-11)5-4-6-13-9/h8-9,11H,4-7H2,1-3H3
InChIKeyQRXSQTOKOOYPFP-UHFFFAOYSA-N
XLogP1.20
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2-tert-butyloxan-3-yl)methanol
CID 79373679
[(1S,2S)-2-[(2R)-oxan-2-yl]oxycyclopentyl]methanol
CID 98113125
4-[(2S,3R)-2-methoxyoxan-3-yl]-2-methylbutan-2-ol
CID 10420393
2-ethoxyoxolane;oxolan-2-ylmethanol
CID 160542333
2-methoxy-2-methylpropane;2-methyloxolane
CID 67153137
[2-[(4-methoxy-4-methylpentan-2-yl)amino]cyclohexyl]methanol
CID 103784997
(2R,3S)-2-(2-tert-butylsilyloxypropan-2-yl)oxan-3-ol
CID 154192723
methanol;[(2S)-oxolan-2-yl]methanol
CID 144618761
2-oxabicyclo[4.2.0]octan-7-ylmethanol
CID 84716262
[(2R,3R)-2-methoxyoxolan-3-yl]methanol
CID 130877552
1-amino-N-[(2-tert-butyloxan-3-yl)methyl]cyclopropane-1-carboxamide;hydrochloride
CID 119795864
1-[(2-tert-butyloxan-3-yl)methyl]-2,3-dimethylguanidine
CID 111428538

Frequently Asked Questions

What is the IUPAC name of [2-(2-methoxypropan-2-yl)oxan-3-yl]methanol?
The IUPAC name of [2-(2-methoxypropan-2-yl)oxan-3-yl]methanol (CID 131115463) is [2-(2-methoxypropan-2-yl)oxan-3-yl]methanol.
What is the SMILES notation for [2-(2-methoxypropan-2-yl)oxan-3-yl]methanol?
The canonical SMILES for [2-(2-methoxypropan-2-yl)oxan-3-yl]methanol is COC(C)(C)C1OCCCC1CO.
What is the InChIKey of [2-(2-methoxypropan-2-yl)oxan-3-yl]methanol?
The InChIKey is QRXSQTOKOOYPFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O3/c1-10(2,12-3)9-8(7-11)5-4-6-13-9/h8-9,11H,4-7H2,1-3H3.
What are the key properties of [2-(2-methoxypropan-2-yl)oxan-3-yl]methanol?
[2-(2-methoxypropan-2-yl)oxan-3-yl]methanol has a molecular weight of 188.27 g/mol, XLogP of 1.20, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-methoxypropan-2-yl)oxan-3-yl]methanol is sourced from PubChem (CID 131115463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).