2-(5-cyclopentyloxolan-3-ylidene)-5,5-dimethyl-1,3-dioxane

C15H24O3 — CID 134988934

IUPAC2-(5-cyclopentyloxolan-3-ylidene)-5,5-dimethyl-1,3-dioxane
SMILESCC1(C)COC(=C2COC(C3CCCC3)C2)OC1
InChIInChI=1S/C15H24O3/c1-15(2)9-17-14(18-10-15)12-7-13(16-8-12)11-5-3-4-6-11/h11,13H,3-10H2,1-2H3
InChIKeyNINHHEHFIMSEEB-UHFFFAOYSA-N
MW252.35 g/mol
LogP3.25
Rot. Bonds1

About 2-(5-cyclopentyloxolan-3-ylidene)-5,5-dimethyl-1,3-dioxane

2-(5-cyclopentyloxolan-3-ylidene)-5,5-dimethyl-1,3-dioxane (PubChem CID 134988934) has the molecular formula C15H24O3 and a molecular weight of 252.35 g/mol. Its IUPAC name is 2-(5-cyclopentyloxolan-3-ylidene)-5,5-dimethyl-1,3-dioxane.

Molecular Properties

Compound Name2-(5-cyclopentyloxolan-3-ylidene)-5,5-dimethyl-1,3-dioxane
PubChem CID134988934
Molecular FormulaC15H24O3
Molecular Weight252.35 g/mol
Exact Mass252.17
IUPAC Name2-(5-cyclopentyloxolan-3-ylidene)-5,5-dimethyl-1,3-dioxane
SMILESCC1(C)COC(=C2COC(C3CCCC3)C2)OC1
InChIInChI=1S/C15H24O3/c1-15(2)9-17-14(18-10-15)12-7-13(16-8-12)11-5-3-4-6-11/h11,13H,3-10H2,1-2H3
InChIKeyNINHHEHFIMSEEB-UHFFFAOYSA-N
XLogP3.25
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.35
LogP ≤ 53.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-(5-cyclopentyloxolan-3-ylidene)-5,5-dimethyl-1,3-dioxane 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

(3aS,7aS)-3a-chloro-2-(5,5-dimethyl-1,3-dioxan-2-ylidene)-1,3,5,6,7,7a-hexahydroinden-4-one
CID 135014258
(4aS,9aR)-4,4a,5,6,7,8,9,9a-octahydrocyclohepta[b]pyran-3-one
CID 59465343
5-cyclopentyl-3-methyl-4,5-dihydro-1,2-oxazole
CID 134260939
2-cyclohexyl-5,5-dimethyl-1,3-oxazinane;hydrochloride
CID 117227188
(3aS,7aR)-2,3,3a,4,5,6,7,7a-octahydro-1-benzofuran
CID 21122216
(NZ)-N-(3,3-dimethyl-2,4a,5,6,7,8,9,10,11,11a-decahydro-1H-benzo[9]annulen-4-ylidene)hydroxylamine
CID 134174397
3,3-dimethyl-1,5-dioxacyclohexadecane-6,16-dione
CID 70605767
6,6-dimethyl-1,4-dioxepan-2-one
CID 10219498
2-cyclobutyl-5,5-dimethyl-1,3-oxazinane
CID 117227173
3,3,12,12-tetramethyl-1,5,10,14-tetraoxacyclooctadecane-6,9,15,18-tetrone
CID 604363
3-cyclododecyl-2,2-dimethyloxirane
CID 84820740
7,7-dimethyl-1,3,5-trioxocane-2,4-dione
CID 88770359

Frequently Asked Questions

What is the IUPAC name of 2-(5-cyclopentyloxolan-3-ylidene)-5,5-dimethyl-1,3-dioxane?
The IUPAC name of 2-(5-cyclopentyloxolan-3-ylidene)-5,5-dimethyl-1,3-dioxane (CID 134988934) is 2-(5-cyclopentyloxolan-3-ylidene)-5,5-dimethyl-1,3-dioxane.
What is the SMILES notation for 2-(5-cyclopentyloxolan-3-ylidene)-5,5-dimethyl-1,3-dioxane?
The canonical SMILES for 2-(5-cyclopentyloxolan-3-ylidene)-5,5-dimethyl-1,3-dioxane is CC1(C)COC(=C2COC(C3CCCC3)C2)OC1.
What is the InChIKey of 2-(5-cyclopentyloxolan-3-ylidene)-5,5-dimethyl-1,3-dioxane?
The InChIKey is NINHHEHFIMSEEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24O3/c1-15(2)9-17-14(18-10-15)12-7-13(16-8-12)11-5-3-4-6-11/h11,13H,3-10H2,1-2H3.
What are the key properties of 2-(5-cyclopentyloxolan-3-ylidene)-5,5-dimethyl-1,3-dioxane?
2-(5-cyclopentyloxolan-3-ylidene)-5,5-dimethyl-1,3-dioxane has a molecular weight of 252.35 g/mol, XLogP of 3.25, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-cyclopentyloxolan-3-ylidene)-5,5-dimethyl-1,3-dioxane is sourced from PubChem (CID 134988934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).