[2-[2-(2-methoxyethoxy)ethoxy]-3-pyridinyl]methanol

C11H17NO4 — CID 104564183

IUPAC[2-[2-(2-methoxyethoxy)ethoxy]-3-pyridinyl]methanol
SMILESCOCCOCCOc1ncccc1CO
InChIInChI=1S/C11H17NO4/c1-14-5-6-15-7-8-16-11-10(9-13)3-2-4-12-11/h2-4,13H,5-9H2,1H3
InChIKeySZBCQNJERFYZTM-UHFFFAOYSA-N
MW227.26 g/mol
LogP0.62
Rot. Bonds8

About [2-[2-(2-methoxyethoxy)ethoxy]-3-pyridinyl]methanol

[2-[2-(2-methoxyethoxy)ethoxy]-3-pyridinyl]methanol (PubChem CID 104564183) has the molecular formula C11H17NO4 and a molecular weight of 227.26 g/mol. Its IUPAC name is [2-[2-(2-methoxyethoxy)ethoxy]-3-pyridinyl]methanol.

Molecular Properties

Compound Name[2-[2-(2-methoxyethoxy)ethoxy]-3-pyridinyl]methanol
PubChem CID104564183
Molecular FormulaC11H17NO4
Molecular Weight227.26 g/mol
Exact Mass227.12
IUPAC Name[2-[2-(2-methoxyethoxy)ethoxy]-3-pyridinyl]methanol
SMILESCOCCOCCOc1ncccc1CO
InChIInChI=1S/C11H17NO4/c1-14-5-6-15-7-8-16-11-10(9-13)3-2-4-12-11/h2-4,13H,5-9H2,1H3
InChIKeySZBCQNJERFYZTM-UHFFFAOYSA-N
XLogP0.62
TPSA60.81 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.26
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

[2-(2-propoxyethoxy)-3-pyridinyl]methanol
CID 63684391
N-[[2-[3-(2-methoxyethoxy)propoxy]-3-pyridinyl]methyl]ethanamine
CID 103405698
N-[[2-(2-methoxyethoxy)-3-pyridinyl]methyl]-2-methylpropan-2-amine
CID 62289999
[2-[2-(diethylamino)ethoxy]-3-pyridinyl]methanol
CID 61256979
[5-bromo-2-[2-(2-methoxyethoxy)ethoxy]-3-pyridinyl]methanol
CID 104564186
N-[[2-[2-(3-methoxypropoxy)ethoxy]-3-pyridinyl]methyl]cyclopropanamine
CID 103180751
[2-[2-(hydroxymethyl)phenoxy]-3-pyridinyl]methanol
CID 63653116
2-[2-(3-methoxypropoxy)ethoxy]pyridine-3-carbothioamide
CID 103177659
[4-(hydroxymethyl)-2,5-bis[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]methanol
CID 86247130
(2-phenylmethoxy-3-pyridinyl)methanol
CID 59210835
N-[2-(hydroxymethyl)phenyl]-2-methoxypyridine-3-carboxamide
CID 61497876
1-(3-butoxypropyl)-3-[[2-(2-methoxyethoxy)-3-pyridinyl]methyl]-2-methylguanidine
CID 111239399

Frequently Asked Questions

What is the IUPAC name of [2-[2-(2-methoxyethoxy)ethoxy]-3-pyridinyl]methanol?
The IUPAC name of [2-[2-(2-methoxyethoxy)ethoxy]-3-pyridinyl]methanol (CID 104564183) is [2-[2-(2-methoxyethoxy)ethoxy]-3-pyridinyl]methanol.
What is the SMILES notation for [2-[2-(2-methoxyethoxy)ethoxy]-3-pyridinyl]methanol?
The canonical SMILES for [2-[2-(2-methoxyethoxy)ethoxy]-3-pyridinyl]methanol is COCCOCCOc1ncccc1CO.
What is the InChIKey of [2-[2-(2-methoxyethoxy)ethoxy]-3-pyridinyl]methanol?
The InChIKey is SZBCQNJERFYZTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO4/c1-14-5-6-15-7-8-16-11-10(9-13)3-2-4-12-11/h2-4,13H,5-9H2,1H3.
What are the key properties of [2-[2-(2-methoxyethoxy)ethoxy]-3-pyridinyl]methanol?
[2-[2-(2-methoxyethoxy)ethoxy]-3-pyridinyl]methanol has a molecular weight of 227.26 g/mol, XLogP of 0.62, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[2-(2-methoxyethoxy)ethoxy]-3-pyridinyl]methanol is sourced from PubChem (CID 104564183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).