2-methyl-2-prop-2-enoxypent-4-en-1-ol

C9H16O2 — CID 10583026

IUPAC2-methyl-2-prop-2-enoxypent-4-en-1-ol
SMILESC=CCOC(C)(CO)CC=C
InChIInChI=1S/C9H16O2/c1-4-6-9(3,8-10)11-7-5-2/h4-5,10H,1-2,6-8H2,3H3
InChIKeyGGOPLRUEAAQOSH-UHFFFAOYSA-N
MW156.22 g/mol
LogP1.52
Rot. Bonds6

About 2-methyl-2-prop-2-enoxypent-4-en-1-ol

2-methyl-2-prop-2-enoxypent-4-en-1-ol (PubChem CID 10583026) has the molecular formula C9H16O2 and a molecular weight of 156.22 g/mol. Its IUPAC name is 2-methyl-2-prop-2-enoxypent-4-en-1-ol.

Molecular Properties

Compound Name2-methyl-2-prop-2-enoxypent-4-en-1-ol
PubChem CID10583026
Molecular FormulaC9H16O2
Molecular Weight156.22 g/mol
Exact Mass156.12
IUPAC Name2-methyl-2-prop-2-enoxypent-4-en-1-ol
SMILESC=CCOC(C)(CO)CC=C
InChIInChI=1S/C9H16O2/c1-4-6-9(3,8-10)11-7-5-2/h4-5,10H,1-2,6-8H2,3H3
InChIKeyGGOPLRUEAAQOSH-UHFFFAOYSA-N
XLogP1.52
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.22
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(2-methyl-3,6-dihydro-2H-pyran-2-yl)methanol
CID 10534676
3-[(1S)-1-prop-2-enoxyethyl]penta-1,4-dien-3-ol
CID 10877518
(2R)-2-methyl-2-prop-2-enoxybut-3-en-1-ol
CID 10942539
Diallyl diethylene glycol
CID 22034395
Diallyltriethylene glycol
CID 87841834
(3R,4R)-4-methoxy-2-methylhex-5-en-3-ol
CID 12755469
3-(1-Prop-2-enoxyethyl)penta-1,4-dien-3-ol
CID 85299270
(2R)-2-(3-hydroxybutoxy)-2-methylbut-3-en-1-ol
CID 100946656
(3R)-3-[(3R)-2-methylpent-1-en-3-yl]oxyhex-5-en-2-ol
CID 134886585
2-Methyl-4-propan-2-yloxyhex-5-en-3-ol
CID 134905984
4-Propan-2-yloxyhex-5-en-3-ol
CID 134978903
2-Methyl-2-(2-methylprop-2-enoxy)but-3-en-1-ol
CID 164680423

Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-prop-2-enoxypent-4-en-1-ol?
The IUPAC name of 2-methyl-2-prop-2-enoxypent-4-en-1-ol (CID 10583026) is 2-methyl-2-prop-2-enoxypent-4-en-1-ol.
What is the SMILES notation for 2-methyl-2-prop-2-enoxypent-4-en-1-ol?
The canonical SMILES for 2-methyl-2-prop-2-enoxypent-4-en-1-ol is C=CCOC(C)(CO)CC=C.
What is the InChIKey of 2-methyl-2-prop-2-enoxypent-4-en-1-ol?
The InChIKey is GGOPLRUEAAQOSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16O2/c1-4-6-9(3,8-10)11-7-5-2/h4-5,10H,1-2,6-8H2,3H3.
What are the key properties of 2-methyl-2-prop-2-enoxypent-4-en-1-ol?
2-methyl-2-prop-2-enoxypent-4-en-1-ol has a molecular weight of 156.22 g/mol, XLogP of 1.52, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-prop-2-enoxypent-4-en-1-ol is sourced from PubChem (CID 10583026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).