(2-methyloxolan-2-yl)-(oxan-3-yl)methanol

C11H20O3 — CID 107136169

IUPAC(2-methyloxolan-2-yl)-(oxan-3-yl)methanol
SMILESCC1(C(O)C2CCCOC2)CCCO1
InChIInChI=1S/C11H20O3/c1-11(5-3-7-14-11)10(12)9-4-2-6-13-8-9/h9-10,12H,2-8H2,1H3
InChIKeyYMBFLFLPZPHMAR-UHFFFAOYSA-N
MW200.28 g/mol
LogP1.34
Rot. Bonds2

About (2-methyloxolan-2-yl)-(oxan-3-yl)methanol

(2-methyloxolan-2-yl)-(oxan-3-yl)methanol (PubChem CID 107136169) has the molecular formula C11H20O3 and a molecular weight of 200.28 g/mol. Its IUPAC name is (2-methyloxolan-2-yl)-(oxan-3-yl)methanol.

Molecular Properties

Compound Name(2-methyloxolan-2-yl)-(oxan-3-yl)methanol
PubChem CID107136169
Molecular FormulaC11H20O3
Molecular Weight200.28 g/mol
Exact Mass200.14
IUPAC Name(2-methyloxolan-2-yl)-(oxan-3-yl)methanol
SMILESCC1(C(O)C2CCCOC2)CCCO1
InChIInChI=1S/C11H20O3/c1-11(5-3-7-14-11)10(12)9-4-2-6-13-8-9/h9-10,12H,2-8H2,1H3
InChIKeyYMBFLFLPZPHMAR-UHFFFAOYSA-N
XLogP1.34
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(1-methylcyclopropyl)-(oxan-3-yl)methanol
CID 107136175
1-[hydroxy(oxan-3-yl)methyl]cyclopentan-1-ol
CID 107136247
N-methyl-1-(2-methyloxan-2-yl)-1-(oxan-3-yl)methanamine
CID 107136743
[1-(aminomethyl)-4,4-dimethylcyclohexyl]-(oxan-3-yl)methanol
CID 79138934
(1-ethoxycyclopentyl)-(oxan-3-yl)methanol
CID 107136224
(3,5-dimethylcyclohexyl)-(2-methyloxan-2-yl)methanol
CID 80685818
(2-methylcyclopropyl)-(oxan-3-yl)methanol
CID 107136124
oxan-3-yl-(2,2,5,5-tetramethyloxolan-3-yl)methanol
CID 114622044
[1-(aminomethyl)-4-ethylcyclohexyl]-(oxan-3-yl)methanol
CID 79138848
[1-(aminomethyl)-3-methylcyclopentyl]-(oxan-3-yl)methanol
CID 79138103
4-methyl-3-(oxan-3-yl)pentan-2-ol
CID 107137352
(3,3-difluorocyclobutyl)-(oxan-3-yl)methanol
CID 131137680

Frequently Asked Questions

What is the IUPAC name of (2-methyloxolan-2-yl)-(oxan-3-yl)methanol?
The IUPAC name of (2-methyloxolan-2-yl)-(oxan-3-yl)methanol (CID 107136169) is (2-methyloxolan-2-yl)-(oxan-3-yl)methanol.
What is the SMILES notation for (2-methyloxolan-2-yl)-(oxan-3-yl)methanol?
The canonical SMILES for (2-methyloxolan-2-yl)-(oxan-3-yl)methanol is CC1(C(O)C2CCCOC2)CCCO1.
What is the InChIKey of (2-methyloxolan-2-yl)-(oxan-3-yl)methanol?
The InChIKey is YMBFLFLPZPHMAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20O3/c1-11(5-3-7-14-11)10(12)9-4-2-6-13-8-9/h9-10,12H,2-8H2,1H3.
What are the key properties of (2-methyloxolan-2-yl)-(oxan-3-yl)methanol?
(2-methyloxolan-2-yl)-(oxan-3-yl)methanol has a molecular weight of 200.28 g/mol, XLogP of 1.34, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methyloxolan-2-yl)-(oxan-3-yl)methanol is sourced from PubChem (CID 107136169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).