(Z,3R,4S)-3-(methoxymethoxymethyl)-2-methyldec-5-en-4-ol

C14H28O3 — CID 11075692

IUPAC(Z,3R,4S)-3-(methoxymethoxymethyl)-2-methyldec-5-en-4-ol
SMILESCCCC/C=C\[C@H](O)[C@@H](COCOC)C(C)C
InChIInChI=1S/C14H28O3/c1-5-6-7-8-9-14(15)13(12(2)3)10-17-11-16-4/h8-9,12-15H,5-7,10-11H2,1-4H3/b9-8-/t13-,14-/m0/s1
InChIKeyFDTOUWPKHREUCZ-GZLNQGQSSA-N
MW244.37 g/mol
LogP2.99
Rot. Bonds10

About (Z,3R,4S)-3-(methoxymethoxymethyl)-2-methyldec-5-en-4-ol

(Z,3R,4S)-3-(methoxymethoxymethyl)-2-methyldec-5-en-4-ol (PubChem CID 11075692) has the molecular formula C14H28O3 and a molecular weight of 244.37 g/mol. Its IUPAC name is (Z,3R,4S)-3-(methoxymethoxymethyl)-2-methyldec-5-en-4-ol.

Molecular Properties

Compound Name(Z,3R,4S)-3-(methoxymethoxymethyl)-2-methyldec-5-en-4-ol
PubChem CID11075692
Molecular FormulaC14H28O3
Molecular Weight244.37 g/mol
Exact Mass244.20
IUPAC Name(Z,3R,4S)-3-(methoxymethoxymethyl)-2-methyldec-5-en-4-ol
SMILESCCCC/C=C\[C@H](O)[C@@H](COCOC)C(C)C
InChIInChI=1S/C14H28O3/c1-5-6-7-8-9-14(15)13(12(2)3)10-17-11-16-4/h8-9,12-15H,5-7,10-11H2,1-4H3/b9-8-/t13-,14-/m0/s1
InChIKeyFDTOUWPKHREUCZ-GZLNQGQSSA-N
XLogP2.99
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.37
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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 (Z,3R,4S)-3-(methoxymethoxymethyl)-2-methyldec-5-en-4-ol with MolForge

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

Launch Full Analysis

Related Compounds

(1S,5R)-5-(dimethoxymethyl)cyclopent-2-en-1-ol
CID 11105627
(1S,4R,6R)-4-(methoxymethoxy)-6-(methoxymethyl)cyclohex-2-en-1-ol
CID 11528544
[(1s,2r,5s)-5-(Methoxymethoxy)cyclopent-3-ene-1,2-diyl]dimethanol
CID 172645646
(E,3S,4R)-2,3-dimethylhept-5-ene-2,4-diol
CID 10374694
(E,3S)-8-(methoxymethoxy)-2-methyloct-4-en-3-ol
CID 11310196
5,6-Dimethylhept-2-ene-1,4-diol
CID 56988445
2,3-Dimethylhept-5-ene-2,4-diol
CID 57196698
6-(1,3-Dioxan-5-yl)hex-4-en-3-ol
CID 70612072
(E,3S,4S)-1,1-dimethoxy-2,2,3-trimethylnon-5-en-4-ol
CID 88851536
(3S)-8-(methoxymethoxy)-2-methyloct-4-en-3-ol
CID 91504657
(4S,5E,7S,8R,9E)-7-ethyl-8-(methoxymethoxy)-5,9-dimethylundeca-1,5,9-trien-4-ol
CID 118517716
(2E,4S,5R,6E)-4-ethyl-5-(methoxymethoxy)-2,6-dimethylocta-2,6-dien-1-ol
CID 118517718

Frequently Asked Questions

What is the IUPAC name of (Z,3R,4S)-3-(methoxymethoxymethyl)-2-methyldec-5-en-4-ol?
The IUPAC name of (Z,3R,4S)-3-(methoxymethoxymethyl)-2-methyldec-5-en-4-ol (CID 11075692) is (Z,3R,4S)-3-(methoxymethoxymethyl)-2-methyldec-5-en-4-ol.
What is the SMILES notation for (Z,3R,4S)-3-(methoxymethoxymethyl)-2-methyldec-5-en-4-ol?
The canonical SMILES for (Z,3R,4S)-3-(methoxymethoxymethyl)-2-methyldec-5-en-4-ol is CCCC/C=C\[C@H](O)[C@@H](COCOC)C(C)C.
What is the InChIKey of (Z,3R,4S)-3-(methoxymethoxymethyl)-2-methyldec-5-en-4-ol?
The InChIKey is FDTOUWPKHREUCZ-GZLNQGQSSA-N. The full InChI is InChI=1S/C14H28O3/c1-5-6-7-8-9-14(15)13(12(2)3)10-17-11-16-4/h8-9,12-15H,5-7,10-11H2,1-4H3/b9-8-/t13-,14-/m0/s1.
What are the key properties of (Z,3R,4S)-3-(methoxymethoxymethyl)-2-methyldec-5-en-4-ol?
(Z,3R,4S)-3-(methoxymethoxymethyl)-2-methyldec-5-en-4-ol has a molecular weight of 244.37 g/mol, XLogP of 2.99, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z,3R,4S)-3-(methoxymethoxymethyl)-2-methyldec-5-en-4-ol is sourced from PubChem (CID 11075692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).