(3-methyloxolan-2-yl)-(6-methyl-3-pyridinyl)methanol

C12H17NO2 — CID 115796862

IUPAC(3-methyloxolan-2-yl)-(6-methyl-3-pyridinyl)methanol
SMILESCc1ccc(C(O)C2OCCC2C)cn1
InChIInChI=1S/C12H17NO2/c1-8-5-6-15-12(8)11(14)10-4-3-9(2)13-7-10/h3-4,7-8,11-12,14H,5-6H2,1-2H3
InChIKeyDGGTVMBZAARZLI-UHFFFAOYSA-N
MW207.27 g/mol
LogP1.85
Rot. Bonds2

About (3-methyloxolan-2-yl)-(6-methyl-3-pyridinyl)methanol

(3-methyloxolan-2-yl)-(6-methyl-3-pyridinyl)methanol (PubChem CID 115796862) has the molecular formula C12H17NO2 and a molecular weight of 207.27 g/mol. Its IUPAC name is (3-methyloxolan-2-yl)-(6-methyl-3-pyridinyl)methanol.

Molecular Properties

Compound Name(3-methyloxolan-2-yl)-(6-methyl-3-pyridinyl)methanol
PubChem CID115796862
Molecular FormulaC12H17NO2
Molecular Weight207.27 g/mol
Exact Mass207.13
IUPAC Name(3-methyloxolan-2-yl)-(6-methyl-3-pyridinyl)methanol
SMILESCc1ccc(C(O)C2OCCC2C)cn1
InChIInChI=1S/C12H17NO2/c1-8-5-6-15-12(8)11(14)10-4-3-9(2)13-7-10/h3-4,7-8,11-12,14H,5-6H2,1-2H3
InChIKeyDGGTVMBZAARZLI-UHFFFAOYSA-N
XLogP1.85
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.27
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[(3-methyloxolan-2-yl)-(6-methyl-3-pyridinyl)methyl]hydrazine
CID 105305599
(2-methylcyclopentyl)-(6-methyl-3-pyridinyl)methanol
CID 107192253
(5-fluoro-3-pyridinyl)-(3-methyloxolan-2-yl)methanol
CID 114981175
(3-methyloxolan-2-yl)-(2-methylphenyl)methanol
CID 114979278
(3-bromo-4-ethoxyphenyl)-(3-methyloxolan-2-yl)methanol
CID 104661160
N-[(2-methyloxolan-3-yl)-(6-methyl-3-pyridinyl)methyl]ethanamine
CID 115854932
1-(6-methyl-3-pyridinyl)-2-(oxan-4-yl)ethanol
CID 104823049
1-(6-methyl-3-pyridinyl)-3-(oxolan-2-yl)propan-1-ol
CID 104822985
(5,6-dimethyl-1,4-dithian-2-yl)-(6-methyl-3-pyridinyl)methanol
CID 103345172
(2-methylcyclopropyl)-(6-methyl-3-pyridinyl)methanamine
CID 65422768
(2-chloro-4,5-dimethylphenyl)-(3-methyloxolan-2-yl)methanol
CID 113319534
(2,3-dichlorophenyl)-(3-methyloxolan-2-yl)methanol
CID 115793140

Frequently Asked Questions

What is the IUPAC name of (3-methyloxolan-2-yl)-(6-methyl-3-pyridinyl)methanol?
The IUPAC name of (3-methyloxolan-2-yl)-(6-methyl-3-pyridinyl)methanol (CID 115796862) is (3-methyloxolan-2-yl)-(6-methyl-3-pyridinyl)methanol.
What is the SMILES notation for (3-methyloxolan-2-yl)-(6-methyl-3-pyridinyl)methanol?
The canonical SMILES for (3-methyloxolan-2-yl)-(6-methyl-3-pyridinyl)methanol is Cc1ccc(C(O)C2OCCC2C)cn1.
What is the InChIKey of (3-methyloxolan-2-yl)-(6-methyl-3-pyridinyl)methanol?
The InChIKey is DGGTVMBZAARZLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO2/c1-8-5-6-15-12(8)11(14)10-4-3-9(2)13-7-10/h3-4,7-8,11-12,14H,5-6H2,1-2H3.
What are the key properties of (3-methyloxolan-2-yl)-(6-methyl-3-pyridinyl)methanol?
(3-methyloxolan-2-yl)-(6-methyl-3-pyridinyl)methanol has a molecular weight of 207.27 g/mol, XLogP of 1.85, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methyloxolan-2-yl)-(6-methyl-3-pyridinyl)methanol is sourced from PubChem (CID 115796862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).