[5-[5-[5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]pentyl]oxolan-2-yl]oxolan-2-yl]methanol

C19H34O5 — CID 132528973

IUPAC[5-[5-[5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]pentyl]oxolan-2-yl]oxolan-2-yl]methanol
SMILESCC1(C)OC[C@@H](CCCCCC2CCC(C3CCC(CO)O3)O2)O1
InChIInChI=1S/C19H34O5/c1-19(2)21-13-16(24-19)7-5-3-4-6-14-8-10-17(22-14)18-11-9-15(12-20)23-18/h14-18,20H,3-13H2,1-2H3/t14?,15?,16-,17?,18?/m1/s1
InChIKeySPMIBKSKBQAYRD-YHGKOVQASA-N
MW342.48 g/mol
LogP3.18
Rot. Bonds8

About [5-[5-[5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]pentyl]oxolan-2-yl]oxolan-2-yl]methanol

[5-[5-[5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]pentyl]oxolan-2-yl]oxolan-2-yl]methanol (PubChem CID 132528973) has the molecular formula C19H34O5 and a molecular weight of 342.48 g/mol. Its IUPAC name is [5-[5-[5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]pentyl]oxolan-2-yl]oxolan-2-yl]methanol.

Molecular Properties

Compound Name[5-[5-[5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]pentyl]oxolan-2-yl]oxolan-2-yl]methanol
PubChem CID132528973
Molecular FormulaC19H34O5
Molecular Weight342.48 g/mol
Exact Mass342.24
IUPAC Name[5-[5-[5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]pentyl]oxolan-2-yl]oxolan-2-yl]methanol
SMILESCC1(C)OC[C@@H](CCCCCC2CCC(C3CCC(CO)O3)O2)O1
InChIInChI=1S/C19H34O5/c1-19(2)21-13-16(24-19)7-5-3-4-6-14-8-10-17(22-14)18-11-9-15(12-20)23-18/h14-18,20H,3-13H2,1-2H3/t14?,15?,16-,17?,18?/m1/s1
InChIKeySPMIBKSKBQAYRD-YHGKOVQASA-N
XLogP3.18
TPSA57.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.48
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze [5-[5-[5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]pentyl]oxolan-2-yl]oxolan-2-yl]methanol 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 [5-[5-[5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]pentyl]oxolan-2-yl]oxolan-2-yl]methanol?
The IUPAC name of [5-[5-[5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]pentyl]oxolan-2-yl]oxolan-2-yl]methanol (CID 132528973) is [5-[5-[5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]pentyl]oxolan-2-yl]oxolan-2-yl]methanol.
What is the SMILES notation for [5-[5-[5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]pentyl]oxolan-2-yl]oxolan-2-yl]methanol?
The canonical SMILES for [5-[5-[5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]pentyl]oxolan-2-yl]oxolan-2-yl]methanol is CC1(C)OC[C@@H](CCCCCC2CCC(C3CCC(CO)O3)O2)O1.
What is the InChIKey of [5-[5-[5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]pentyl]oxolan-2-yl]oxolan-2-yl]methanol?
The InChIKey is SPMIBKSKBQAYRD-YHGKOVQASA-N. The full InChI is InChI=1S/C19H34O5/c1-19(2)21-13-16(24-19)7-5-3-4-6-14-8-10-17(22-14)18-11-9-15(12-20)23-18/h14-18,20H,3-13H2,1-2H3/t14?,15?,16-,17?,18?/m1/s1.
What are the key properties of [5-[5-[5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]pentyl]oxolan-2-yl]oxolan-2-yl]methanol?
[5-[5-[5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]pentyl]oxolan-2-yl]oxolan-2-yl]methanol has a molecular weight of 342.48 g/mol, XLogP of 3.18, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [5-[5-[5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]pentyl]oxolan-2-yl]oxolan-2-yl]methanol is sourced from PubChem (CID 132528973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).