(2Z,3Z)-3-(methylsulfanylmethylidene)-2-propylideneoxolane

C9H14OS — CID 142123041

IUPAC(2Z,3Z)-3-(methylsulfanylmethylidene)-2-propylideneoxolane
SMILESCC/C=C1\OCC\C1=C\SC
InChIInChI=1S/C9H14OS/c1-3-4-9-8(7-11-2)5-6-10-9/h4,7H,3,5-6H2,1-2H3/b8-7-,9-4-
InChIKeyWZUMKEFXROLDEZ-PNVIUGFYSA-N
MW170.28 g/mol
LogP2.95
Rot. Bonds2

About (2Z,3Z)-3-(methylsulfanylmethylidene)-2-propylideneoxolane

(2Z,3Z)-3-(methylsulfanylmethylidene)-2-propylideneoxolane (PubChem CID 142123041) has the molecular formula C9H14OS and a molecular weight of 170.28 g/mol. Its IUPAC name is (2Z,3Z)-3-(methylsulfanylmethylidene)-2-propylideneoxolane.

Molecular Properties

Compound Name(2Z,3Z)-3-(methylsulfanylmethylidene)-2-propylideneoxolane
PubChem CID142123041
Molecular FormulaC9H14OS
Molecular Weight170.28 g/mol
Exact Mass170.08
IUPAC Name(2Z,3Z)-3-(methylsulfanylmethylidene)-2-propylideneoxolane
SMILESCC/C=C1\OCC\C1=C\SC
InChIInChI=1S/C9H14OS/c1-3-4-9-8(7-11-2)5-6-10-9/h4,7H,3,5-6H2,1-2H3/b8-7-,9-4-
InChIKeyWZUMKEFXROLDEZ-PNVIUGFYSA-N
XLogP2.95
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.28
LogP ≤ 52.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze (2Z,3Z)-3-(methylsulfanylmethylidene)-2-propylideneoxolane 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

(2E,3Z)-2-ethylidene-3-propylideneoxolane
CID 142121655
(2E,3E)-2-[(Z)-3-methylsulfanylprop-2-enylidene]-3-propylidene-1,4-dioxane
CID 142042284
(4E,5E)-4-ethylidene-5-propylidene-1,3-dioxolane
CID 88980689
(3E)-3-propylideneoxan-2-one
CID 13398830
(E)-[(3Z)-3-ethylideneoxolan-2-ylidene]methanamine
CID 144833852
(2Z,4Z)-2-(4-methyl-3,4,5,6-tetrahydroazepin-2-ylidene)-4-propylideneoxane-3-thione
CID 123203534
3-ethylidene-2-prop-2-enylideneoxolane
CID 91481308
(3Z)-3-decylideneoxolan-2-one
CID 13315995
ethane;(3E,4Z)-4-prop-2-enylidene-3-propylideneoxane
CID 143806870
2-[(Z)-[(2E)-2-ethylideneoxolan-3-ylidene]methyl]-4,4-dimethylpent-1-en-3-amine
CID 142856991
(5Z,6E)-5-ethylidene-3-methyl-6-propylidene-1,3-oxazinan-2-one
CID 144547297
4,7-diethyl-2,3-dihydrofuro[2,3-d]pyridazine
CID 89016017

Frequently Asked Questions

What is the IUPAC name of (2Z,3Z)-3-(methylsulfanylmethylidene)-2-propylideneoxolane?
The IUPAC name of (2Z,3Z)-3-(methylsulfanylmethylidene)-2-propylideneoxolane (CID 142123041) is (2Z,3Z)-3-(methylsulfanylmethylidene)-2-propylideneoxolane.
What is the SMILES notation for (2Z,3Z)-3-(methylsulfanylmethylidene)-2-propylideneoxolane?
The canonical SMILES for (2Z,3Z)-3-(methylsulfanylmethylidene)-2-propylideneoxolane is CC/C=C1\OCC\C1=C\SC.
What is the InChIKey of (2Z,3Z)-3-(methylsulfanylmethylidene)-2-propylideneoxolane?
The InChIKey is WZUMKEFXROLDEZ-PNVIUGFYSA-N. The full InChI is InChI=1S/C9H14OS/c1-3-4-9-8(7-11-2)5-6-10-9/h4,7H,3,5-6H2,1-2H3/b8-7-,9-4-.
What are the key properties of (2Z,3Z)-3-(methylsulfanylmethylidene)-2-propylideneoxolane?
(2Z,3Z)-3-(methylsulfanylmethylidene)-2-propylideneoxolane has a molecular weight of 170.28 g/mol, XLogP of 2.95, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z,3Z)-3-(methylsulfanylmethylidene)-2-propylideneoxolane is sourced from PubChem (CID 142123041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).