[3-(3-methoxypropyl)-2-methyloxolan-3-yl]methanol

C10H20O3 — CID 114535558

IUPAC[3-(3-methoxypropyl)-2-methyloxolan-3-yl]methanol
SMILESCOCCCC1(CO)CCOC1C
InChIInChI=1S/C10H20O3/c1-9-10(8-11,5-7-13-9)4-3-6-12-2/h9,11H,3-8H2,1-2H3
InChIKeyGPDPTBYMWNQGAV-UHFFFAOYSA-N
MW188.27 g/mol
LogP1.20
Rot. Bonds5

About [3-(3-methoxypropyl)-2-methyloxolan-3-yl]methanol

[3-(3-methoxypropyl)-2-methyloxolan-3-yl]methanol (PubChem CID 114535558) has the molecular formula C10H20O3 and a molecular weight of 188.27 g/mol. Its IUPAC name is [3-(3-methoxypropyl)-2-methyloxolan-3-yl]methanol.

Molecular Properties

Compound Name[3-(3-methoxypropyl)-2-methyloxolan-3-yl]methanol
PubChem CID114535558
Molecular FormulaC10H20O3
Molecular Weight188.27 g/mol
Exact Mass188.14
IUPAC Name[3-(3-methoxypropyl)-2-methyloxolan-3-yl]methanol
SMILESCOCCCC1(CO)CCOC1C
InChIInChI=1S/C10H20O3/c1-9-10(8-11,5-7-13-9)4-3-6-12-2/h9,11H,3-8H2,1-2H3
InChIKeyGPDPTBYMWNQGAV-UHFFFAOYSA-N
XLogP1.20
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

6-Oxaspiro[3.4]octan-1-OL
CID 71744010
{2,8-Dioxaspiro[4.5]decan-3-yl}methanol
CID 137704220
2-[(3S,5S)-4,4,5-trimethyloxolan-3-yl]ethanol
CID 130832826
[2-Methyl-3-[3-(2,2,2-trifluoroethoxy)propyl]oxolan-3-yl]methanol
CID 114535537
(3-Ethyl-5,5-dimethyloxolan-3-yl)methanol
CID 15365933
2-(Methoxymethyl)-4,5-dimethyloxolan-3-ol
CID 18736589
1-(Oxolan-3-yl)propan-2-ol
CID 20162978
(3,3,4,4,5-Pentamethyloxolan-2-yl)methanol
CID 20584500
6-Methoxy-3,3,5-trimethylhexan-2-ol
CID 23563783
[3-(Hydroxymethyl)-2-pentyloxolan-3-yl]methanol
CID 57234361
2,4,5-Trimethyl-2-[(2-methylpropan-2-yl)oxymethyl]oxolane-3,4-diol
CID 57764446
(2S,3R,4S,5S)-4,5-bis(hydroxymethyl)-2,4-dimethyloxolan-3-ol
CID 58503415

Frequently Asked Questions

What is the IUPAC name of [3-(3-methoxypropyl)-2-methyloxolan-3-yl]methanol?
The IUPAC name of [3-(3-methoxypropyl)-2-methyloxolan-3-yl]methanol (CID 114535558) is [3-(3-methoxypropyl)-2-methyloxolan-3-yl]methanol.
What is the SMILES notation for [3-(3-methoxypropyl)-2-methyloxolan-3-yl]methanol?
The canonical SMILES for [3-(3-methoxypropyl)-2-methyloxolan-3-yl]methanol is COCCCC1(CO)CCOC1C.
What is the InChIKey of [3-(3-methoxypropyl)-2-methyloxolan-3-yl]methanol?
The InChIKey is GPDPTBYMWNQGAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O3/c1-9-10(8-11,5-7-13-9)4-3-6-12-2/h9,11H,3-8H2,1-2H3.
What are the key properties of [3-(3-methoxypropyl)-2-methyloxolan-3-yl]methanol?
[3-(3-methoxypropyl)-2-methyloxolan-3-yl]methanol has a molecular weight of 188.27 g/mol, XLogP of 1.20, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(3-methoxypropyl)-2-methyloxolan-3-yl]methanol is sourced from PubChem (CID 114535558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).