2-methyl-2-(3-methylpentyl)-1,3-dioxolane

C10H20O2 — CID 13315713

IUPAC2-methyl-2-(3-methylpentyl)-1,3-dioxolane
SMILESCCC(C)CCC1(C)OCCO1
InChIInChI=1S/C10H20O2/c1-4-9(2)5-6-10(3)11-7-8-12-10/h9H,4-8H2,1-3H3
InChIKeyZIAGRLZKIFNWOA-UHFFFAOYSA-N
MW172.27 g/mol
LogP2.58
Rot. Bonds4

About 2-methyl-2-(3-methylpentyl)-1,3-dioxolane

2-methyl-2-(3-methylpentyl)-1,3-dioxolane (PubChem CID 13315713) has the molecular formula C10H20O2 and a molecular weight of 172.27 g/mol. Its IUPAC name is 2-methyl-2-(3-methylpentyl)-1,3-dioxolane.

Molecular Properties

Compound Name2-methyl-2-(3-methylpentyl)-1,3-dioxolane
PubChem CID13315713
Molecular FormulaC10H20O2
Molecular Weight172.27 g/mol
Exact Mass172.15
IUPAC Name2-methyl-2-(3-methylpentyl)-1,3-dioxolane
SMILESCCC(C)CCC1(C)OCCO1
InChIInChI=1S/C10H20O2/c1-4-9(2)5-6-10(3)11-7-8-12-10/h9H,4-8H2,1-3H3
InChIKeyZIAGRLZKIFNWOA-UHFFFAOYSA-N
XLogP2.58
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.27
LogP ≤ 52.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-methyl-2-(3-methylpentyl)-1,3-dioxolane 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

2-methyl-6-(2-methyl-1,3-dioxolan-2-yl)hexan-3-ol
CID 14689313
2-methyl-2-propyl-1,3,6-trioxocane
CID 89306416
2-methyl-2-(3-methylbut-3-enyl)-1,3-dioxolane
CID 130120416
2-methyl-2-nonyl-1,3-dioxolane
CID 10013506
2-[(2R)-5-iodo-2-methylpentyl]-2-methyl-1,3-dioxolane
CID 10990159
[1,1-dichloro-5-(2-methyl-1,3-dioxolan-2-yl)pent-1-en-3-yl]-trimethylsilane
CID 101483838
2-ethyl-2,5-dimethyl-8-(2-methyl-1,3-dioxolan-2-yl)octanoic acid
CID 70994716
2,5,5-trimethyl-2-(2-methylbutyl)-1,3-dioxane
CID 129172366
2-methyl-2-(2-propylsulfanylethyl)-1,3-dioxolane
CID 13315742
ethane;2,5,5-trimethyl-2-(3-methylbutyl)-1,3-dioxane
CID 144504372
5-(2-methyl-1,3-dioxolan-2-yl)pentan-2-one;2-methyl-4-(2-methyl-1,3-dioxolan-2-yl)butanal
CID 161106627
4-[2-(2-methyl-1,3-dioxolan-2-yl)ethylamino]pentan-1-ol
CID 104628582

Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-(3-methylpentyl)-1,3-dioxolane?
The IUPAC name of 2-methyl-2-(3-methylpentyl)-1,3-dioxolane (CID 13315713) is 2-methyl-2-(3-methylpentyl)-1,3-dioxolane.
What is the SMILES notation for 2-methyl-2-(3-methylpentyl)-1,3-dioxolane?
The canonical SMILES for 2-methyl-2-(3-methylpentyl)-1,3-dioxolane is CCC(C)CCC1(C)OCCO1.
What is the InChIKey of 2-methyl-2-(3-methylpentyl)-1,3-dioxolane?
The InChIKey is ZIAGRLZKIFNWOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O2/c1-4-9(2)5-6-10(3)11-7-8-12-10/h9H,4-8H2,1-3H3.
What are the key properties of 2-methyl-2-(3-methylpentyl)-1,3-dioxolane?
2-methyl-2-(3-methylpentyl)-1,3-dioxolane has a molecular weight of 172.27 g/mol, XLogP of 2.58, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-(3-methylpentyl)-1,3-dioxolane is sourced from PubChem (CID 13315713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).