3-(methoxymethoxymethyl)-5-phenylpent-1-en-3-ol

C14H20O3 — CID 10014342

IUPAC3-(methoxymethoxymethyl)-5-phenylpent-1-en-3-ol
SMILESC=CC(O)(CCc1ccccc1)COCOC
InChIInChI=1S/C14H20O3/c1-3-14(15,11-17-12-16-2)10-9-13-7-5-4-6-8-13/h3-8,15H,1,9-12H2,2H3
InChIKeyXSFAAZSZMXJZMN-UHFFFAOYSA-N
MW236.31 g/mol
LogP2.16
Rot. Bonds8

About 3-(methoxymethoxymethyl)-5-phenylpent-1-en-3-ol

3-(methoxymethoxymethyl)-5-phenylpent-1-en-3-ol (PubChem CID 10014342) has the molecular formula C14H20O3 and a molecular weight of 236.31 g/mol. Its IUPAC name is 3-(methoxymethoxymethyl)-5-phenylpent-1-en-3-ol.

Molecular Properties

Compound Name3-(methoxymethoxymethyl)-5-phenylpent-1-en-3-ol
PubChem CID10014342
Molecular FormulaC14H20O3
Molecular Weight236.31 g/mol
Exact Mass236.14
IUPAC Name3-(methoxymethoxymethyl)-5-phenylpent-1-en-3-ol
SMILESC=CC(O)(CCc1ccccc1)COCOC
InChIInChI=1S/C14H20O3/c1-3-14(15,11-17-12-16-2)10-9-13-7-5-4-6-8-13/h3-8,15H,1,9-12H2,2H3
InChIKeyXSFAAZSZMXJZMN-UHFFFAOYSA-N
XLogP2.16
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 52.16
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'}

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Related Compounds

(E,4S)-6-methyl-4-(2-phenylethyl)hept-2-en-4-ol
CID 154719951
4-hydroxy-4-(2-phenylethyl)hex-5-en-3-one
CID 145233908
(3R)-3-(methoxymethoxymethoxy)-3-(2-phenylethyl)hexanal
CID 10494034
(4S)-4-[tert-butyl(dimethyl)silyl]oxy-4-[[tert-butyl(diphenyl)silyl]oxymethyl]-5-(methoxymethoxy)-3-methylpent-1-en-3-ol
CID 102195851
methoxymethoxymethyl (3R)-3-(methoxymethoxymethoxy)-3-(2-phenylethyl)hexanoate
CID 10620039
2-methoxy-2-methyl-4-phenylbutanal
CID 105446188
2-hydroxy-2-methyl-4-phenylbutanal
CID 10241365
2-methyl-1,4-diphenylbutan-2-ol
CID 103642101
2,2-diethyl-4-phenylbutanenitrile
CID 82138721
(3-hydroperoxy-3-methylbutyl)benzene
CID 12643770
benzyl (3S)-3-methyl-3-(2-phenylethyl)pent-4-enoate
CID 132522279
(3R)-1-(methoxymethoxy)-3-methyl-6-(phenylmethoxymethoxy)hexan-3-ol
CID 100990652

Frequently Asked Questions

What is the IUPAC name of 3-(methoxymethoxymethyl)-5-phenylpent-1-en-3-ol?
The IUPAC name of 3-(methoxymethoxymethyl)-5-phenylpent-1-en-3-ol (CID 10014342) is 3-(methoxymethoxymethyl)-5-phenylpent-1-en-3-ol.
What is the SMILES notation for 3-(methoxymethoxymethyl)-5-phenylpent-1-en-3-ol?
The canonical SMILES for 3-(methoxymethoxymethyl)-5-phenylpent-1-en-3-ol is C=CC(O)(CCc1ccccc1)COCOC.
What is the InChIKey of 3-(methoxymethoxymethyl)-5-phenylpent-1-en-3-ol?
The InChIKey is XSFAAZSZMXJZMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20O3/c1-3-14(15,11-17-12-16-2)10-9-13-7-5-4-6-8-13/h3-8,15H,1,9-12H2,2H3.
What are the key properties of 3-(methoxymethoxymethyl)-5-phenylpent-1-en-3-ol?
3-(methoxymethoxymethyl)-5-phenylpent-1-en-3-ol has a molecular weight of 236.31 g/mol, XLogP of 2.16, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methoxymethoxymethyl)-5-phenylpent-1-en-3-ol is sourced from PubChem (CID 10014342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).