3-(3-pent-4-enoxyphenyl)thiophene

C15H16OS — CID 19086978

IUPAC3-(3-pent-4-enoxyphenyl)thiophene
SMILESC=CCCCOc1cccc(-c2ccsc2)c1
InChIInChI=1S/C15H16OS/c1-2-3-4-9-16-15-7-5-6-13(11-15)14-8-10-17-12-14/h2,5-8,10-12H,1,3-4,9H2
InChIKeyUURVQUMCMQTHBE-UHFFFAOYSA-N
MW244.36 g/mol
LogP4.76
Rot. Bonds6

About 3-(3-pent-4-enoxyphenyl)thiophene

3-(3-pent-4-enoxyphenyl)thiophene (PubChem CID 19086978) has the molecular formula C15H16OS and a molecular weight of 244.36 g/mol. Its IUPAC name is 3-(3-pent-4-enoxyphenyl)thiophene.

Molecular Properties

Compound Name3-(3-pent-4-enoxyphenyl)thiophene
PubChem CID19086978
Molecular FormulaC15H16OS
Molecular Weight244.36 g/mol
Exact Mass244.09
IUPAC Name3-(3-pent-4-enoxyphenyl)thiophene
SMILESC=CCCCOc1cccc(-c2ccsc2)c1
InChIInChI=1S/C15H16OS/c1-2-3-4-9-16-15-7-5-6-13(11-15)14-8-10-17-12-14/h2,5-8,10-12H,1,3-4,9H2
InChIKeyUURVQUMCMQTHBE-UHFFFAOYSA-N
XLogP4.76
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.36
LogP ≤ 54.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-[2-(3-thiophen-3-ylphenoxy)ethoxy]acetaldehyde
CID 54097921
1-nitro-3-pent-4-enoxybenzene
CID 11183362
1-methoxy-3-pent-4-enoxybenzene
CID 10750277
1-fluoro-3-pent-4-enoxybenzene
CID 64764365
[3-[(3-thiophen-3-ylphenoxy)methyl]phenyl]methanol
CID 54262502
1-(bromomethyl)-3-pent-4-enoxybenzene
CID 86076126
cyclopenta[c]thiopyran
CID 584139
N-ethyl-2-[2-(3-thiophen-3-ylphenoxy)ethylsulfanyl]ethanamine
CID 19917000
methyl 2-[2-(3-thiophen-3-ylphenoxy)ethoxy]propanoate
CID 19917015
3-[3-[(5Z,8E)-6-ethyl-12,12-dimethyltrideca-5,8-dien-10-ynoxy]phenyl]thiophene
CID 19390177
1-bromo-3-hex-5-enoxybenzene
CID 146004224
6,12,12-trimethyl-1-(3-thiophen-3-ylphenoxy)tridec-8-en-10-yn-5-ol
CID 54362824

Frequently Asked Questions

What is the IUPAC name of 3-(3-pent-4-enoxyphenyl)thiophene?
The IUPAC name of 3-(3-pent-4-enoxyphenyl)thiophene (CID 19086978) is 3-(3-pent-4-enoxyphenyl)thiophene.
What is the SMILES notation for 3-(3-pent-4-enoxyphenyl)thiophene?
The canonical SMILES for 3-(3-pent-4-enoxyphenyl)thiophene is C=CCCCOc1cccc(-c2ccsc2)c1.
What is the InChIKey of 3-(3-pent-4-enoxyphenyl)thiophene?
The InChIKey is UURVQUMCMQTHBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16OS/c1-2-3-4-9-16-15-7-5-6-13(11-15)14-8-10-17-12-14/h2,5-8,10-12H,1,3-4,9H2.
What are the key properties of 3-(3-pent-4-enoxyphenyl)thiophene?
3-(3-pent-4-enoxyphenyl)thiophene has a molecular weight of 244.36 g/mol, XLogP of 4.76, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-pent-4-enoxyphenyl)thiophene is sourced from PubChem (CID 19086978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).