[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-1,3-oxazol-4-yl]methanol

C11H19NO6 — CID 113427161

IUPAC[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-1,3-oxazol-4-yl]methanol
SMILESCOCCOCCOCCOc1nc(CO)co1
InChIInChI=1S/C11H19NO6/c1-14-2-3-15-4-5-16-6-7-17-11-12-10(8-13)9-18-11/h9,13H,2-8H2,1H3
InChIKeyNJQZDKIODPBZQO-UHFFFAOYSA-N
MW261.27 g/mol
LogP0.23
Rot. Bonds11

About [2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-1,3-oxazol-4-yl]methanol

[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-1,3-oxazol-4-yl]methanol (PubChem CID 113427161) has the molecular formula C11H19NO6 and a molecular weight of 261.27 g/mol. Its IUPAC name is [2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-1,3-oxazol-4-yl]methanol.

Molecular Properties

Compound Name[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-1,3-oxazol-4-yl]methanol
PubChem CID113427161
Molecular FormulaC11H19NO6
Molecular Weight261.27 g/mol
Exact Mass261.12
IUPAC Name[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-1,3-oxazol-4-yl]methanol
SMILESCOCCOCCOCCOc1nc(CO)co1
InChIInChI=1S/C11H19NO6/c1-14-2-3-15-4-5-16-6-7-17-11-12-10(8-13)9-18-11/h9,13H,2-8H2,1H3
InChIKeyNJQZDKIODPBZQO-UHFFFAOYSA-N
XLogP0.23
TPSA83.18 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds11
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.27
LogP ≤ 50.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Related Compounds

[6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-2-pyridinyl]methanol
CID 104564147
ethyl 2-[3-(2-methoxyethoxy)propoxy]-1,3-oxazole-4-carboxylate
CID 103401572
[5-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-2-pyridinyl]methanol
CID 104564081
[4-(hydroxymethyl)-2,5-bis[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]methanol
CID 86247130
[2-[3-(2-methoxyethoxy)propoxy]-6-propyl-4-pyridinyl]methanol
CID 103403974
[2-[2-(2-methoxyethoxy)ethoxy]-3-pyridinyl]methanol
CID 104564183
ethanol;1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane
CID 87301416
2-ethyl-6-[2-(2-methoxyethoxy)ethoxy]pyridine-4-carboxylic acid
CID 104560469
1,2-dimethoxyethane;1-methoxy-2-(2-methoxyethoxy)ethane;1-methoxy-2-[2-(2-methoxyethoxy)ethoxy]ethane;1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane
CID 159847962
1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane
CID 87439194
1-methoxy-2-[2-(2-methoxyethoxy)ethoxy]ethane
CID 8189
N-[[2-ethyl-6-[2-(2-methoxyethoxy)ethoxy]-4-pyridinyl]methyl]ethanamine
CID 104566462

Frequently Asked Questions

What is the IUPAC name of [2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-1,3-oxazol-4-yl]methanol?
The IUPAC name of [2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-1,3-oxazol-4-yl]methanol (CID 113427161) is [2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-1,3-oxazol-4-yl]methanol.
What is the SMILES notation for [2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-1,3-oxazol-4-yl]methanol?
The canonical SMILES for [2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-1,3-oxazol-4-yl]methanol is COCCOCCOCCOc1nc(CO)co1.
What is the InChIKey of [2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-1,3-oxazol-4-yl]methanol?
The InChIKey is NJQZDKIODPBZQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO6/c1-14-2-3-15-4-5-16-6-7-17-11-12-10(8-13)9-18-11/h9,13H,2-8H2,1H3.
What are the key properties of [2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-1,3-oxazol-4-yl]methanol?
[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-1,3-oxazol-4-yl]methanol has a molecular weight of 261.27 g/mol, XLogP of 0.23, 11 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-1,3-oxazol-4-yl]methanol is sourced from PubChem (CID 113427161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).