2-(2-methylbutoxy)pent-1-ene

C10H20O — CID 89028794

IUPAC2-(2-methylbutoxy)pent-1-ene
SMILESC=C(CCC)OCC(C)CC
InChIInChI=1S/C10H20O/c1-5-7-10(4)11-8-9(3)6-2/h9H,4-8H2,1-3H3
InChIKeyGWLUONUDEZUFLX-UHFFFAOYSA-N
MW156.27 g/mol
LogP3.36
Rot. Bonds6

About 2-(2-methylbutoxy)pent-1-ene

2-(2-methylbutoxy)pent-1-ene (PubChem CID 89028794) has the molecular formula C10H20O and a molecular weight of 156.27 g/mol. Its IUPAC name is 2-(2-methylbutoxy)pent-1-ene.

Molecular Properties

Compound Name2-(2-methylbutoxy)pent-1-ene
PubChem CID89028794
Molecular FormulaC10H20O
Molecular Weight156.27 g/mol
Exact Mass156.15
IUPAC Name2-(2-methylbutoxy)pent-1-ene
SMILESC=C(CCC)OCC(C)CC
InChIInChI=1S/C10H20O/c1-5-7-10(4)11-8-9(3)6-2/h9H,4-8H2,1-3H3
InChIKeyGWLUONUDEZUFLX-UHFFFAOYSA-N
XLogP3.36
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.27
LogP ≤ 53.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Related Compounds

2-Methoxy-4-methyl-1-pentene
CID 143008
2-Vinyloxy-4-methyl-1-pentene
CID 143810
2-Butoxybut-1-ene
CID 13211539
Ethyl 1-isopentylvinyl ether
CID 89670721
2-Isopropoxy-3-methyl-1-butene
CID 143366
2-(2,2-Difluoroethoxy)-3-methylpent-1-ene
CID 132121957
3-Fluoro-4-methyl-2-propan-2-yloxypent-1-ene
CID 163762693
3-Methyl-2-methylideneoxolane
CID 20587740
3-Ethyl-2-methoxypent-1-ene
CID 123530231
(3S,4S)-3,4-dimethyl-5-[(2-methylpropan-2-yl)oxy]pent-1-ene
CID 14979453
4-(Butoxymethyl)octa-1,5,6-triene
CID 134982431
2-Ethoxy-4-methyl-3-methylidenepent-1-ene
CID 135015059

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylbutoxy)pent-1-ene?
The IUPAC name of 2-(2-methylbutoxy)pent-1-ene (CID 89028794) is 2-(2-methylbutoxy)pent-1-ene.
What is the SMILES notation for 2-(2-methylbutoxy)pent-1-ene?
The canonical SMILES for 2-(2-methylbutoxy)pent-1-ene is C=C(CCC)OCC(C)CC.
What is the InChIKey of 2-(2-methylbutoxy)pent-1-ene?
The InChIKey is GWLUONUDEZUFLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O/c1-5-7-10(4)11-8-9(3)6-2/h9H,4-8H2,1-3H3.
What are the key properties of 2-(2-methylbutoxy)pent-1-ene?
2-(2-methylbutoxy)pent-1-ene has a molecular weight of 156.27 g/mol, XLogP of 3.36, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylbutoxy)pent-1-ene is sourced from PubChem (CID 89028794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).