2-methyl-6-(2-methyl-1,3-dioxolan-2-yl)hexan-3-ol

C11H22O3 — CID 14689313

IUPAC2-methyl-6-(2-methyl-1,3-dioxolan-2-yl)hexan-3-ol
SMILESCC(C)C(O)CCCC1(C)OCCO1
InChIInChI=1S/C11H22O3/c1-9(2)10(12)5-4-6-11(3)13-7-8-14-11/h9-10,12H,4-8H2,1-3H3
InChIKeyWLBXWINIPUXVIV-UHFFFAOYSA-N
MW202.29 g/mol
LogP1.94
Rot. Bonds5

About 2-methyl-6-(2-methyl-1,3-dioxolan-2-yl)hexan-3-ol

2-methyl-6-(2-methyl-1,3-dioxolan-2-yl)hexan-3-ol (PubChem CID 14689313) has the molecular formula C11H22O3 and a molecular weight of 202.29 g/mol. Its IUPAC name is 2-methyl-6-(2-methyl-1,3-dioxolan-2-yl)hexan-3-ol.

Molecular Properties

Compound Name2-methyl-6-(2-methyl-1,3-dioxolan-2-yl)hexan-3-ol
PubChem CID14689313
Molecular FormulaC11H22O3
Molecular Weight202.29 g/mol
Exact Mass202.16
IUPAC Name2-methyl-6-(2-methyl-1,3-dioxolan-2-yl)hexan-3-ol
SMILESCC(C)C(O)CCCC1(C)OCCO1
InChIInChI=1S/C11H22O3/c1-9(2)10(12)5-4-6-11(3)13-7-8-14-11/h9-10,12H,4-8H2,1-3H3
InChIKeyWLBXWINIPUXVIV-UHFFFAOYSA-N
XLogP1.94
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.29
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-methyl-6-(2-methyl-1,3-dioxolan-2-yl)hexan-3-ol 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

(4S,5S)-5-hydroxy-4,6-dimethyl-1-(2-methyl-1,3-dioxolan-2-yl)heptan-3-one
CID 23583269
2-methyl-2-(3-methylpentyl)-1,3-dioxolane
CID 13315713
2-(4-chlorobutyl)-2-methyl-1,3-dioxolane
CID 10965102
2-methyl-2-nonyl-1,3-dioxolane
CID 10013506
5-(2-methyl-1,3-dioxolan-2-yl)pentan-2-one;2-methyl-4-(2-methyl-1,3-dioxolan-2-yl)butanal
CID 161106627
2-ethyl-2,5-dimethyl-8-(2-methyl-1,3-dioxolan-2-yl)octanoic acid
CID 70994716
4-[2-(2-methyl-1,3-dioxolan-2-yl)ethylamino]pentan-1-ol
CID 104628582
[1,1-dichloro-5-(2-methyl-1,3-dioxolan-2-yl)pent-1-en-3-yl]-trimethylsilane
CID 101483838
(R)-2-methyl-N-[(3R)-2-methyl-2,6-bis(2-methyl-1,3-dioxolan-2-yl)hexan-3-yl]propane-2-sulfinamide
CID 71566933
(3R)-2,7-dimethyloct-7-en-3-ol
CID 124511716
2,7-dimethyloct-7-en-3-ol
CID 79185633
2-methyl-2-(3-methylbut-3-enyl)-1,3-dioxolane
CID 130120416

Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-(2-methyl-1,3-dioxolan-2-yl)hexan-3-ol?
The IUPAC name of 2-methyl-6-(2-methyl-1,3-dioxolan-2-yl)hexan-3-ol (CID 14689313) is 2-methyl-6-(2-methyl-1,3-dioxolan-2-yl)hexan-3-ol.
What is the SMILES notation for 2-methyl-6-(2-methyl-1,3-dioxolan-2-yl)hexan-3-ol?
The canonical SMILES for 2-methyl-6-(2-methyl-1,3-dioxolan-2-yl)hexan-3-ol is CC(C)C(O)CCCC1(C)OCCO1.
What is the InChIKey of 2-methyl-6-(2-methyl-1,3-dioxolan-2-yl)hexan-3-ol?
The InChIKey is WLBXWINIPUXVIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22O3/c1-9(2)10(12)5-4-6-11(3)13-7-8-14-11/h9-10,12H,4-8H2,1-3H3.
What are the key properties of 2-methyl-6-(2-methyl-1,3-dioxolan-2-yl)hexan-3-ol?
2-methyl-6-(2-methyl-1,3-dioxolan-2-yl)hexan-3-ol has a molecular weight of 202.29 g/mol, XLogP of 1.94, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-(2-methyl-1,3-dioxolan-2-yl)hexan-3-ol is sourced from PubChem (CID 14689313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).