2-(1,2-dimethylcyclopropyl)oxane

C10H18O — CID 57035000

IUPAC2-(1,2-dimethylcyclopropyl)oxane
SMILESCC1CC1(C)C1CCCCO1
InChIInChI=1S/C10H18O/c1-8-7-10(8,2)9-5-3-4-6-11-9/h8-9H,3-7H2,1-2H3
InChIKeyIFPDLAFDYHSKTH-UHFFFAOYSA-N
MW154.25 g/mol
LogP2.60
Rot. Bonds1

About 2-(1,2-dimethylcyclopropyl)oxane

2-(1,2-dimethylcyclopropyl)oxane (PubChem CID 57035000) has the molecular formula C10H18O and a molecular weight of 154.25 g/mol. Its IUPAC name is 2-(1,2-dimethylcyclopropyl)oxane.

Molecular Properties

Compound Name2-(1,2-dimethylcyclopropyl)oxane
PubChem CID57035000
Molecular FormulaC10H18O
Molecular Weight154.25 g/mol
Exact Mass154.14
IUPAC Name2-(1,2-dimethylcyclopropyl)oxane
SMILESCC1CC1(C)C1CCCCO1
InChIInChI=1S/C10H18O/c1-8-7-10(8,2)9-5-3-4-6-11-9/h8-9H,3-7H2,1-2H3
InChIKeyIFPDLAFDYHSKTH-UHFFFAOYSA-N
XLogP2.60
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.25
LogP ≤ 52.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 2-(1,2-dimethylcyclopropyl)oxane 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-1-(oxan-2-yl)cyclopropan-1-amine
CID 84650279
2,4-dimethyl-2-(oxan-2-yl)-1,3-oxazolidine
CID 117227926
2-(1,2,2-trimethylcyclooctyl)oxocane
CID 174920418
2-methyl-2-(oxan-2-yl)pyrrolidine
CID 105434283
1-(oxan-2-yl)cyclopropan-1-ol
CID 54404305
2-(1-methylcyclohexyl)oxolane
CID 23594551
2-methyloxane;hydrochloride
CID 141105834
2-[1-(chloromethyl)cyclobutyl]oxane
CID 165443357
4-chloro-2-methyl-2-(oxolan-2-yl)oxane
CID 130577734
[2-methyl-2-(oxan-2-yl)-1,3-dioxolan-4-yl]methanamine
CID 117169010
(1S,8R)-6-cyclohexyl-8-methyl-2-oxa-6-azabicyclo[6.1.0]nonan-7-one
CID 132528243
2-[2-(cyclopenten-1-yl)-1,2,3,3-tetramethylcyclooctyl]oxocane
CID 175468869

Frequently Asked Questions

What is the IUPAC name of 2-(1,2-dimethylcyclopropyl)oxane?
The IUPAC name of 2-(1,2-dimethylcyclopropyl)oxane (CID 57035000) is 2-(1,2-dimethylcyclopropyl)oxane.
What is the SMILES notation for 2-(1,2-dimethylcyclopropyl)oxane?
The canonical SMILES for 2-(1,2-dimethylcyclopropyl)oxane is CC1CC1(C)C1CCCCO1.
What is the InChIKey of 2-(1,2-dimethylcyclopropyl)oxane?
The InChIKey is IFPDLAFDYHSKTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O/c1-8-7-10(8,2)9-5-3-4-6-11-9/h8-9H,3-7H2,1-2H3.
What are the key properties of 2-(1,2-dimethylcyclopropyl)oxane?
2-(1,2-dimethylcyclopropyl)oxane has a molecular weight of 154.25 g/mol, XLogP of 2.60, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,2-dimethylcyclopropyl)oxane is sourced from PubChem (CID 57035000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).