(2S)-2-methoxy-2-pent-1-enyloxane

C11H20O2 — CID 67905082

IUPAC(2S)-2-methoxy-2-pent-1-enyloxane
SMILESCCCC=C[C@]1(OC)CCCCO1
InChIInChI=1S/C11H20O2/c1-3-4-5-8-11(12-2)9-6-7-10-13-11/h5,8H,3-4,6-7,9-10H2,1-2H3/t11-/m1/s1
InChIKeyOYUHJKMJJLAWNE-LLVKDONJSA-N
MW184.28 g/mol
LogP2.89
Rot. Bonds4

About (2S)-2-methoxy-2-pent-1-enyloxane

(2S)-2-methoxy-2-pent-1-enyloxane (PubChem CID 67905082) has the molecular formula C11H20O2 and a molecular weight of 184.28 g/mol. Its IUPAC name is (2S)-2-methoxy-2-pent-1-enyloxane.

Molecular Properties

Compound Name(2S)-2-methoxy-2-pent-1-enyloxane
PubChem CID67905082
Molecular FormulaC11H20O2
Molecular Weight184.28 g/mol
Exact Mass184.15
IUPAC Name(2S)-2-methoxy-2-pent-1-enyloxane
SMILESCCCC=C[C@]1(OC)CCCCO1
InChIInChI=1S/C11H20O2/c1-3-4-5-8-11(12-2)9-6-7-10-13-11/h5,8H,3-4,6-7,9-10H2,1-2H3/t11-/m1/s1
InChIKeyOYUHJKMJJLAWNE-LLVKDONJSA-N
XLogP2.89
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 52.89
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

(E)-2-(2,4-Hexadiynylidene)-1,6-dioxaspiro[4.5]dec-3-ene
CID 5458645
1,7-Dioxaspiro[5.5]undec-4-ene
CID 565984
1,6-Dioxaspiro(4.5)dec-3-ene, 2-(2,4-hexadiynylidene)-, (E)-
CID 327391
3,7-Dimethyl-1,10-dioxaspiro[4.5]dec-3-ene
CID 10535117
(2Z,5R)-2-hexa-2,4-diynylidene-1,10-dioxaspiro[4.5]dec-3-ene
CID 10608668
(2E,5R)-2-hexa-2,4-diynylidene-1,10-dioxaspiro[4.5]dec-3-ene
CID 10846300
Bohlmann K4087
CID 6109338
1,7-Dioxaspiro[5.5]undec-3-ene
CID 10103357
1,6-Dioxaspiro[4.5]dec-3-ene
CID 13841628
(5R)-2-(Hexa-2,4-diyn-1-ylidene)-1,6-dioxaspiro[4.5]dec-3-ene
CID 71406266
(6R)-1,7-dioxaspiro[5.5]undec-4-ene
CID 13841635
(3R,6S)-3-ethyl-1,7-dioxaspiro[5.5]undec-10-ene
CID 101608922

Frequently Asked Questions

What is the IUPAC name of (2S)-2-methoxy-2-pent-1-enyloxane?
The IUPAC name of (2S)-2-methoxy-2-pent-1-enyloxane (CID 67905082) is (2S)-2-methoxy-2-pent-1-enyloxane.
What is the SMILES notation for (2S)-2-methoxy-2-pent-1-enyloxane?
The canonical SMILES for (2S)-2-methoxy-2-pent-1-enyloxane is CCCC=C[C@]1(OC)CCCCO1.
What is the InChIKey of (2S)-2-methoxy-2-pent-1-enyloxane?
The InChIKey is OYUHJKMJJLAWNE-LLVKDONJSA-N. The full InChI is InChI=1S/C11H20O2/c1-3-4-5-8-11(12-2)9-6-7-10-13-11/h5,8H,3-4,6-7,9-10H2,1-2H3/t11-/m1/s1.
What are the key properties of (2S)-2-methoxy-2-pent-1-enyloxane?
(2S)-2-methoxy-2-pent-1-enyloxane has a molecular weight of 184.28 g/mol, XLogP of 2.89, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-methoxy-2-pent-1-enyloxane is sourced from PubChem (CID 67905082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).