3-(4-methoxypent-3-enyl)thiophene

C10H14OS — CID 163190308

IUPAC3-(4-methoxypent-3-enyl)thiophene
SMILESCOC(C)=CCCc1ccsc1
InChIInChI=1S/C10H14OS/c1-9(11-2)4-3-5-10-6-7-12-8-10/h4,6-8H,3,5H2,1-2H3
InChIKeyZIWJMUUUGGFRQC-UHFFFAOYSA-N
MW182.29 g/mol
LogP3.23
Rot. Bonds4

About 3-(4-methoxypent-3-enyl)thiophene

3-(4-methoxypent-3-enyl)thiophene (PubChem CID 163190308) has the molecular formula C10H14OS and a molecular weight of 182.29 g/mol. Its IUPAC name is 3-(4-methoxypent-3-enyl)thiophene.

Molecular Properties

Compound Name3-(4-methoxypent-3-enyl)thiophene
PubChem CID163190308
Molecular FormulaC10H14OS
Molecular Weight182.29 g/mol
Exact Mass182.08
IUPAC Name3-(4-methoxypent-3-enyl)thiophene
SMILESCOC(C)=CCCc1ccsc1
InChIInChI=1S/C10H14OS/c1-9(11-2)4-3-5-10-6-7-12-8-10/h4,6-8H,3,5H2,1-2H3
InChIKeyZIWJMUUUGGFRQC-UHFFFAOYSA-N
XLogP3.23
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.29
LogP ≤ 53.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Related Compounds

3-[(3E,7E,11E,15E)-4,8,12,16,20-pentamethylhenicosa-3,7,11,15,19-pentaenyl]thiophene
CID 54588649
6-methyl-N-(2-thiophen-3-ylethyl)hept-5-en-2-amine
CID 115708370
3-[(3E,7E,11E,15E)-4,8,12,16-tetramethylicosa-3,7,11,15,19-pentaenyl]thiophene
CID 89431360
3-[(3E,7E,11E,15E)-4,8,12,16-tetramethylicosa-3,7,11,15-tetraenyl]thiophene
CID 89431390
3-(4,8,12,16-tetramethylicosa-3,7,11,15-tetraenyl)thiophene
CID 123768255
3-[(3E,7E,11E)-4-ethyl-8,12,16-trimethylheptadeca-3,7,11,15-tetraenyl]thiophene
CID 89431402
3-(4,8,12,16,20,22-hexamethyltricosa-3,7,11,15,19-pentaenyl)thiophene
CID 123295614
1-methoxy-N-methyl-4-thiophen-3-ylbutan-2-amine
CID 62319829
methyl (E)-2-methyl-4-(thiophen-3-ylmethylamino)but-2-enoate
CID 103250546
azane;3-propylthiophene
CID 174446539
4-methoxy-1-thiophen-3-ylbutan-2-ol
CID 62606552
ethane;3-(4-methylpent-4-enyl)thiophene
CID 145466682

Frequently Asked Questions

What is the IUPAC name of 3-(4-methoxypent-3-enyl)thiophene?
The IUPAC name of 3-(4-methoxypent-3-enyl)thiophene (CID 163190308) is 3-(4-methoxypent-3-enyl)thiophene.
What is the SMILES notation for 3-(4-methoxypent-3-enyl)thiophene?
The canonical SMILES for 3-(4-methoxypent-3-enyl)thiophene is COC(C)=CCCc1ccsc1.
What is the InChIKey of 3-(4-methoxypent-3-enyl)thiophene?
The InChIKey is ZIWJMUUUGGFRQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14OS/c1-9(11-2)4-3-5-10-6-7-12-8-10/h4,6-8H,3,5H2,1-2H3.
What are the key properties of 3-(4-methoxypent-3-enyl)thiophene?
3-(4-methoxypent-3-enyl)thiophene has a molecular weight of 182.29 g/mol, XLogP of 3.23, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methoxypent-3-enyl)thiophene is sourced from PubChem (CID 163190308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).