2-methyl-2-penta-3,4-dienyl-1,3-thiazolidine

C9H15NS — CID 3058789

IUPAC2-methyl-2-penta-3,4-dienyl-1,3-thiazolidine
SMILESC=C=CCCC1(C)NCCS1
InChIInChI=1S/C9H15NS/c1-3-4-5-6-9(2)10-7-8-11-9/h4,10H,1,5-8H2,2H3
InChIKeyQACMFMCVAMDINW-UHFFFAOYSA-N
MW169.29 g/mol
LogP2.16
Rot. Bonds3

About 2-methyl-2-penta-3,4-dienyl-1,3-thiazolidine

2-methyl-2-penta-3,4-dienyl-1,3-thiazolidine (PubChem CID 3058789) has the molecular formula C9H15NS and a molecular weight of 169.29 g/mol. Its IUPAC name is 2-methyl-2-penta-3,4-dienyl-1,3-thiazolidine.

Molecular Properties

Compound Name2-methyl-2-penta-3,4-dienyl-1,3-thiazolidine
PubChem CID3058789
Molecular FormulaC9H15NS
Molecular Weight169.29 g/mol
Exact Mass169.09
IUPAC Name2-methyl-2-penta-3,4-dienyl-1,3-thiazolidine
SMILESC=C=CCCC1(C)NCCS1
InChIInChI=1S/C9H15NS/c1-3-4-5-6-9(2)10-7-8-11-9/h4,10H,1,5-8H2,2H3
InChIKeyQACMFMCVAMDINW-UHFFFAOYSA-N
XLogP2.16
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.29
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-methyl-2-penta-3,4-dienyl-1,3-thiazolidine 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-2-(4-methylpent-3-en-1-yl)-1,3-thiazolidine
CID 3040236
2-Methyl-2-(pent-4-en-1-yl)-1,3-thiazolidine
CID 3058785
Thiazolidine, 2-(3-pentenyl)-, (E)-
CID 6447464
Thiazolidine, 2-(3-heptenyl)-2-methyl-, (E)-
CID 6447468
Thiazolidine, 2-(3,6-heptadienyl)-2-methyl-, (E)-
CID 6447469
2-(But-3-en-1-yl)-2-methyl-1,3-thiazolidine
CID 3058778
2-Methyl-2-(3-methylbut-3-en-1-yl)-1,3-thiazolidine
CID 3058781
2-(Hex-5-en-1-yl)-2-methyl-1,3-thiazolidine
CID 3058791
Thiazolidine, 2-(4,5-hexadienyl)-2-methyl-
CID 3058793
Thiazolidine, 2-methyl-2-(3-pentenyl)-, (E)-
CID 6447466
Thiazolidine, 2-(3,5-hexadienyl)-2-methyl-, (E)-
CID 6447467
Methyl-4-ethyl-5-methylenethiazolidine
CID 129721983

Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-penta-3,4-dienyl-1,3-thiazolidine?
The IUPAC name of 2-methyl-2-penta-3,4-dienyl-1,3-thiazolidine (CID 3058789) is 2-methyl-2-penta-3,4-dienyl-1,3-thiazolidine.
What is the SMILES notation for 2-methyl-2-penta-3,4-dienyl-1,3-thiazolidine?
The canonical SMILES for 2-methyl-2-penta-3,4-dienyl-1,3-thiazolidine is C=C=CCCC1(C)NCCS1.
What is the InChIKey of 2-methyl-2-penta-3,4-dienyl-1,3-thiazolidine?
The InChIKey is QACMFMCVAMDINW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NS/c1-3-4-5-6-9(2)10-7-8-11-9/h4,10H,1,5-8H2,2H3.
What are the key properties of 2-methyl-2-penta-3,4-dienyl-1,3-thiazolidine?
2-methyl-2-penta-3,4-dienyl-1,3-thiazolidine has a molecular weight of 169.29 g/mol, XLogP of 2.16, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-penta-3,4-dienyl-1,3-thiazolidine is sourced from PubChem (CID 3058789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).