(4R)-4-(2-methoxyethoxymethoxy)-5-prop-2-enoxypent-1-ene

C12H22O4 — CID 25133555

IUPAC(4R)-4-(2-methoxyethoxymethoxy)-5-prop-2-enoxypent-1-ene
SMILESC=CCOC[C@@H](CC=C)OCOCCOC
InChIInChI=1S/C12H22O4/c1-4-6-12(10-14-7-5-2)16-11-15-9-8-13-3/h4-5,12H,1-2,6-11H2,3H3/t12-/m1/s1
InChIKeyBVCZMTRYOBZOGY-GFCCVEGCSA-N
MW230.30 g/mol
LogP1.77
Rot. Bonds12

About (4R)-4-(2-methoxyethoxymethoxy)-5-prop-2-enoxypent-1-ene

(4R)-4-(2-methoxyethoxymethoxy)-5-prop-2-enoxypent-1-ene (PubChem CID 25133555) has the molecular formula C12H22O4 and a molecular weight of 230.30 g/mol. Its IUPAC name is (4R)-4-(2-methoxyethoxymethoxy)-5-prop-2-enoxypent-1-ene.

Molecular Properties

Compound Name(4R)-4-(2-methoxyethoxymethoxy)-5-prop-2-enoxypent-1-ene
PubChem CID25133555
Molecular FormulaC12H22O4
Molecular Weight230.30 g/mol
Exact Mass230.15
IUPAC Name(4R)-4-(2-methoxyethoxymethoxy)-5-prop-2-enoxypent-1-ene
SMILESC=CCOC[C@@H](CC=C)OCOCCOC
InChIInChI=1S/C12H22O4/c1-4-6-12(10-14-7-5-2)16-11-15-9-8-13-3/h4-5,12H,1-2,6-11H2,3H3/t12-/m1/s1
InChIKeyBVCZMTRYOBZOGY-GFCCVEGCSA-N
XLogP1.77
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds12
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.30
LogP ≤ 51.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze (4R)-4-(2-methoxyethoxymethoxy)-5-prop-2-enoxypent-1-ene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (4R)-4-(2-methoxyethoxymethoxy)-5-prop-2-enoxypent-1-ene?
The IUPAC name of (4R)-4-(2-methoxyethoxymethoxy)-5-prop-2-enoxypent-1-ene (CID 25133555) is (4R)-4-(2-methoxyethoxymethoxy)-5-prop-2-enoxypent-1-ene.
What is the SMILES notation for (4R)-4-(2-methoxyethoxymethoxy)-5-prop-2-enoxypent-1-ene?
The canonical SMILES for (4R)-4-(2-methoxyethoxymethoxy)-5-prop-2-enoxypent-1-ene is C=CCOC[C@@H](CC=C)OCOCCOC.
What is the InChIKey of (4R)-4-(2-methoxyethoxymethoxy)-5-prop-2-enoxypent-1-ene?
The InChIKey is BVCZMTRYOBZOGY-GFCCVEGCSA-N. The full InChI is InChI=1S/C12H22O4/c1-4-6-12(10-14-7-5-2)16-11-15-9-8-13-3/h4-5,12H,1-2,6-11H2,3H3/t12-/m1/s1.
What are the key properties of (4R)-4-(2-methoxyethoxymethoxy)-5-prop-2-enoxypent-1-ene?
(4R)-4-(2-methoxyethoxymethoxy)-5-prop-2-enoxypent-1-ene has a molecular weight of 230.30 g/mol, XLogP of 1.77, 12 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-(2-methoxyethoxymethoxy)-5-prop-2-enoxypent-1-ene is sourced from PubChem (CID 25133555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).