4-[(2-ethyl-6-methyl-3-pyridinyl)oxy]butan-1-ol

C12H19NO2 — CID 103175334

IUPAC4-[(2-ethyl-6-methyl-3-pyridinyl)oxy]butan-1-ol
SMILESCCc1nc(C)ccc1OCCCCO
InChIInChI=1S/C12H19NO2/c1-3-11-12(7-6-10(2)13-11)15-9-5-4-8-14/h6-7,14H,3-5,8-9H2,1-2H3
InChIKeyWTFZQCGEUNICFO-UHFFFAOYSA-N
MW209.29 g/mol
LogP2.10
Rot. Bonds6

About 4-[(2-ethyl-6-methyl-3-pyridinyl)oxy]butan-1-ol

4-[(2-ethyl-6-methyl-3-pyridinyl)oxy]butan-1-ol (PubChem CID 103175334) has the molecular formula C12H19NO2 and a molecular weight of 209.29 g/mol. Its IUPAC name is 4-[(2-ethyl-6-methyl-3-pyridinyl)oxy]butan-1-ol.

Molecular Properties

Compound Name4-[(2-ethyl-6-methyl-3-pyridinyl)oxy]butan-1-ol
PubChem CID103175334
Molecular FormulaC12H19NO2
Molecular Weight209.29 g/mol
Exact Mass209.14
IUPAC Name4-[(2-ethyl-6-methyl-3-pyridinyl)oxy]butan-1-ol
SMILESCCc1nc(C)ccc1OCCCCO
InChIInChI=1S/C12H19NO2/c1-3-11-12(7-6-10(2)13-11)15-9-5-4-8-14/h6-7,14H,3-5,8-9H2,1-2H3
InChIKeyWTFZQCGEUNICFO-UHFFFAOYSA-N
XLogP2.10
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 52.10
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

3-(6-chlorohexoxy)-2-ethyl-6-methylpyridine
CID 103174559
4-[(2-ethyl-6-methyl-3-pyridinyl)oxy]butan-1-amine
CID 103174470
6-[[2-[(cyclopropylamino)methyl]-6-methyl-3-pyridinyl]oxy]hexan-1-ol
CID 107702712
2-ethyl-6-methyl-3-(3-methylsulfonylpropoxy)pyridine
CID 99831600
3-[(2-ethyl-6-methyl-3-pyridinyl)oxy]propanoic acid
CID 103174229
[3-(3-methoxypropoxy)-6-methyl-2-pyridinyl]methanol
CID 79157840
[3-[3-(dimethylamino)propoxy]-6-methyl-2-pyridinyl]methanol
CID 114525688
[4-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]phenyl]methanol
CID 103175335
N-[2-[(2-ethyl-6-methyl-3-pyridinyl)oxy]ethyl]-2-methoxyethanamine
CID 103175724
2-(6-methyl-3-pentoxy-2-pyridinyl)ethanamine
CID 79168982
[6-methyl-3-(3,3,3-trifluoropropoxy)-2-pyridinyl]methanol
CID 79158379
4-[[2-(hydroxymethyl)-6-methyl-3-pyridinyl]oxy]-2-methylbutan-2-ol
CID 79356219

Frequently Asked Questions

What is the IUPAC name of 4-[(2-ethyl-6-methyl-3-pyridinyl)oxy]butan-1-ol?
The IUPAC name of 4-[(2-ethyl-6-methyl-3-pyridinyl)oxy]butan-1-ol (CID 103175334) is 4-[(2-ethyl-6-methyl-3-pyridinyl)oxy]butan-1-ol.
What is the SMILES notation for 4-[(2-ethyl-6-methyl-3-pyridinyl)oxy]butan-1-ol?
The canonical SMILES for 4-[(2-ethyl-6-methyl-3-pyridinyl)oxy]butan-1-ol is CCc1nc(C)ccc1OCCCCO.
What is the InChIKey of 4-[(2-ethyl-6-methyl-3-pyridinyl)oxy]butan-1-ol?
The InChIKey is WTFZQCGEUNICFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO2/c1-3-11-12(7-6-10(2)13-11)15-9-5-4-8-14/h6-7,14H,3-5,8-9H2,1-2H3.
What are the key properties of 4-[(2-ethyl-6-methyl-3-pyridinyl)oxy]butan-1-ol?
4-[(2-ethyl-6-methyl-3-pyridinyl)oxy]butan-1-ol has a molecular weight of 209.29 g/mol, XLogP of 2.10, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-ethyl-6-methyl-3-pyridinyl)oxy]butan-1-ol is sourced from PubChem (CID 103175334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).