2-[(2-methyl-5-prop-1-en-2-ylcyclopentyl)methoxy]oxane

C15H26O2 — CID 559128

IUPAC2-[(2-methyl-5-prop-1-en-2-ylcyclopentyl)methoxy]oxane
SMILESC=C(C)C1CCC(C)C1COC1CCCCO1
InChIInChI=1S/C15H26O2/c1-11(2)13-8-7-12(3)14(13)10-17-15-6-4-5-9-16-15/h12-15H,1,4-10H2,2-3H3
InChIKeyZCMGUSZGAOXTAM-UHFFFAOYSA-N
MW238.37 g/mol
LogP3.77
Rot. Bonds4

About 2-[(2-methyl-5-prop-1-en-2-ylcyclopentyl)methoxy]oxane

2-[(2-methyl-5-prop-1-en-2-ylcyclopentyl)methoxy]oxane (PubChem CID 559128) has the molecular formula C15H26O2 and a molecular weight of 238.37 g/mol. Its IUPAC name is 2-[(2-methyl-5-prop-1-en-2-ylcyclopentyl)methoxy]oxane.

Molecular Properties

Compound Name2-[(2-methyl-5-prop-1-en-2-ylcyclopentyl)methoxy]oxane
PubChem CID559128
Molecular FormulaC15H26O2
Molecular Weight238.37 g/mol
Exact Mass238.19
IUPAC Name2-[(2-methyl-5-prop-1-en-2-ylcyclopentyl)methoxy]oxane
SMILESC=C(C)C1CCC(C)C1COC1CCCCO1
InChIInChI=1S/C15H26O2/c1-11(2)13-8-7-12(3)14(13)10-17-15-6-4-5-9-16-15/h12-15H,1,4-10H2,2-3H3
InChIKeyZCMGUSZGAOXTAM-UHFFFAOYSA-N
XLogP3.77
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 53.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(4aS,7R,7aR)-1-Methoxy-4,7-dimethyl-1,4a,5,6,7,7a-hexahydrocyclopenta(c)pyran
CID 71356025
(1R)-1-[3-(1-ethoxyethoxy)propyl]-2-methylidenecyclopentane
CID 139263558
(1R,2R,3R)-2-(methoxymethoxymethyl)-1-methyl-3-prop-1-en-2-ylcyclopentane
CID 11171610
2-[2-(2-Dodecyl-3-methylidenecyclopropyl)ethoxy]oxane
CID 53919354
8,10-Dioxatricyclo[7.4.0.02,6]tridec-6-ene
CID 54413202
2-(4,8-Dimethylnon-8-enoxy)oxane
CID 58892852
1-(1-Ethoxyethoxy)-4,7-dimethyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran
CID 67823061
(1R)-1-(1-ethoxyethoxy)-4,7-dimethyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran
CID 67823062
(7aR)-1-(1-ethoxyethoxy)-4,7-dimethyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran
CID 67823105
2-[2-[(1R,2S)-2-dodecyl-3-methylidenecyclopropyl]ethoxy]oxane
CID 67908195
2-[2-[(1S,2R)-2-dodecyl-3-methylidenecyclopropyl]ethoxy]oxane
CID 67908197
(1S, 4aS, 7S, 7aR)-1-[1-(ethoxy)ethoxy]-1,4a,5,6,7,7a-hexahydro-4,7-dimethylcyclopenta[c]pyran
CID 86747421

Frequently Asked Questions

What is the IUPAC name of 2-[(2-methyl-5-prop-1-en-2-ylcyclopentyl)methoxy]oxane?
The IUPAC name of 2-[(2-methyl-5-prop-1-en-2-ylcyclopentyl)methoxy]oxane (CID 559128) is 2-[(2-methyl-5-prop-1-en-2-ylcyclopentyl)methoxy]oxane.
What is the SMILES notation for 2-[(2-methyl-5-prop-1-en-2-ylcyclopentyl)methoxy]oxane?
The canonical SMILES for 2-[(2-methyl-5-prop-1-en-2-ylcyclopentyl)methoxy]oxane is C=C(C)C1CCC(C)C1COC1CCCCO1.
What is the InChIKey of 2-[(2-methyl-5-prop-1-en-2-ylcyclopentyl)methoxy]oxane?
The InChIKey is ZCMGUSZGAOXTAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26O2/c1-11(2)13-8-7-12(3)14(13)10-17-15-6-4-5-9-16-15/h12-15H,1,4-10H2,2-3H3.
What are the key properties of 2-[(2-methyl-5-prop-1-en-2-ylcyclopentyl)methoxy]oxane?
2-[(2-methyl-5-prop-1-en-2-ylcyclopentyl)methoxy]oxane has a molecular weight of 238.37 g/mol, XLogP of 3.77, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-methyl-5-prop-1-en-2-ylcyclopentyl)methoxy]oxane is sourced from PubChem (CID 559128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).