3-(3-methylidenepentyl)thiophene

C10H14S — CID 143047550

IUPAC3-(3-methylidenepentyl)thiophene
SMILESC=C(CC)CCc1ccsc1
InChIInChI=1S/C10H14S/c1-3-9(2)4-5-10-6-7-11-8-10/h6-8H,2-5H2,1H3
InChIKeyGATGCOWHLCGMON-UHFFFAOYSA-N
MW166.29 g/mol
LogP3.65
Rot. Bonds4

About 3-(3-methylidenepentyl)thiophene

3-(3-methylidenepentyl)thiophene (PubChem CID 143047550) has the molecular formula C10H14S and a molecular weight of 166.29 g/mol. Its IUPAC name is 3-(3-methylidenepentyl)thiophene.

Molecular Properties

Compound Name3-(3-methylidenepentyl)thiophene
PubChem CID143047550
Molecular FormulaC10H14S
Molecular Weight166.29 g/mol
Exact Mass166.08
IUPAC Name3-(3-methylidenepentyl)thiophene
SMILESC=C(CC)CCc1ccsc1
InChIInChI=1S/C10H14S/c1-3-9(2)4-5-10-6-7-11-8-10/h6-8H,2-5H2,1H3
InChIKeyGATGCOWHLCGMON-UHFFFAOYSA-N
XLogP3.65
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.29
LogP ≤ 53.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

ethane;3-(4-methylpent-4-enyl)thiophene
CID 145466682
azane;3-propylthiophene
CID 174446539
4-methyl-1-thiophen-3-ylheptan-3-one
CID 114972135
(E)-1-thiophen-3-ylhept-4-en-3-one
CID 103454342
3-heptylthiophene;3-hexylthiophene
CID 159152668
4-(diethylamino)-4-ethyl-1-thiophen-3-ylhexan-3-one
CID 79061299
1-(3-methylthiophen-2-yl)-3-thiophen-3-ylpropan-1-one
CID 114972087
2-ethyl-2-(2-thiophen-3-ylethyl)propane-1,3-diol
CID 79450472
3,4-dimethyl-1-thiophen-3-ylpentan-3-ol
CID 65146406
3-but-1-en-2-ylthiophene
CID 91086928
4-thiophen-3-ylbutan-1-ol
CID 54222621
N-butyl-N-ethyl-3-thiophen-3-ylpropanamide
CID 86978752

Frequently Asked Questions

What is the IUPAC name of 3-(3-methylidenepentyl)thiophene?
The IUPAC name of 3-(3-methylidenepentyl)thiophene (CID 143047550) is 3-(3-methylidenepentyl)thiophene.
What is the SMILES notation for 3-(3-methylidenepentyl)thiophene?
The canonical SMILES for 3-(3-methylidenepentyl)thiophene is C=C(CC)CCc1ccsc1.
What is the InChIKey of 3-(3-methylidenepentyl)thiophene?
The InChIKey is GATGCOWHLCGMON-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14S/c1-3-9(2)4-5-10-6-7-11-8-10/h6-8H,2-5H2,1H3.
What are the key properties of 3-(3-methylidenepentyl)thiophene?
3-(3-methylidenepentyl)thiophene has a molecular weight of 166.29 g/mol, XLogP of 3.65, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-methylidenepentyl)thiophene is sourced from PubChem (CID 143047550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).