1-cyclopent-2-en-1-yl-4-prop-2-enoxybenzene

C14H16O — CID 3027235

IUPAC1-cyclopent-2-en-1-yl-4-prop-2-enoxybenzene
SMILESC=CCOc1ccc(C2C=CCC2)cc1
InChIInChI=1S/C14H16O/c1-2-11-15-14-9-7-13(8-10-14)12-5-3-4-6-12/h2-3,5,7-10,12H,1,4,6,11H2
InChIKeyRGWCRUJUFAWSPH-UHFFFAOYSA-N
MW200.28 g/mol
LogP3.68
Rot. Bonds4

About 1-cyclopent-2-en-1-yl-4-prop-2-enoxybenzene

1-cyclopent-2-en-1-yl-4-prop-2-enoxybenzene (PubChem CID 3027235) has the molecular formula C14H16O and a molecular weight of 200.28 g/mol. Its IUPAC name is 1-cyclopent-2-en-1-yl-4-prop-2-enoxybenzene.

Molecular Properties

Compound Name1-cyclopent-2-en-1-yl-4-prop-2-enoxybenzene
PubChem CID3027235
Molecular FormulaC14H16O
Molecular Weight200.28 g/mol
Exact Mass200.12
IUPAC Name1-cyclopent-2-en-1-yl-4-prop-2-enoxybenzene
SMILESC=CCOc1ccc(C2C=CCC2)cc1
InChIInChI=1S/C14H16O/c1-2-11-15-14-9-7-13(8-10-14)12-5-3-4-6-12/h2-3,5,7-10,12H,1,4,6,11H2
InChIKeyRGWCRUJUFAWSPH-UHFFFAOYSA-N
XLogP3.68
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 53.68
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

1-cyclopent-2-en-1-yl-4-[3-(4-cyclopent-2-en-1-ylphenoxy)propoxy]benzene
CID 3064819
ethyl 2-(4-cyclopent-2-en-1-ylphenoxy)acetate
CID 13161755
(2S)-2-(4-prop-2-enoxyphenyl)aziridine
CID 55263639
(2S)-1-[4-[(1R)-cyclopent-2-en-1-yl]phenoxy]-3-[4-[(2S)-3-[4-[(1R)-cyclopent-2-en-1-yl]phenoxy]-2-hydroxypropyl]piperazin-1-yl]propan-2-ol
CID 51621551
2-(4-prop-2-enoxyphenyl)-1,3-dithiolane
CID 11230160
(2S)-1-[4-[(1S)-cyclopent-2-en-1-yl]phenoxy]-3-piperidin-1-ium-1-ylpropan-2-ol
CID 7371477
2-[(1S,4R)-4-[4-(2-oxoethoxy)phenyl]cyclohex-2-en-1-yl]oxyacetaldehyde
CID 118066431
N-[(4-prop-2-enoxyphenyl)methyl]thian-4-amine
CID 115615614
1,4-bis[2-(4-prop-2-enoxyphenyl)ethenyl]benzene
CID 89211050
1-(bromomethoxy)-4-prop-2-enoxybenzene
CID 23452925
3,6-bis[(4-prop-2-enoxyphenyl)methyl]piperazine-2,5-dione
CID 168859066
2-(4-ethenylcyclohexyl)-6-prop-2-enoxynaphthalene
CID 139861791

Frequently Asked Questions

What is the IUPAC name of 1-cyclopent-2-en-1-yl-4-prop-2-enoxybenzene?
The IUPAC name of 1-cyclopent-2-en-1-yl-4-prop-2-enoxybenzene (CID 3027235) is 1-cyclopent-2-en-1-yl-4-prop-2-enoxybenzene.
What is the SMILES notation for 1-cyclopent-2-en-1-yl-4-prop-2-enoxybenzene?
The canonical SMILES for 1-cyclopent-2-en-1-yl-4-prop-2-enoxybenzene is C=CCOc1ccc(C2C=CCC2)cc1.
What is the InChIKey of 1-cyclopent-2-en-1-yl-4-prop-2-enoxybenzene?
The InChIKey is RGWCRUJUFAWSPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16O/c1-2-11-15-14-9-7-13(8-10-14)12-5-3-4-6-12/h2-3,5,7-10,12H,1,4,6,11H2.
What are the key properties of 1-cyclopent-2-en-1-yl-4-prop-2-enoxybenzene?
1-cyclopent-2-en-1-yl-4-prop-2-enoxybenzene has a molecular weight of 200.28 g/mol, XLogP of 3.68, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopent-2-en-1-yl-4-prop-2-enoxybenzene is sourced from PubChem (CID 3027235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).