2-ethoxy-2-methyl-1-(5-propan-2-yloxy-3-pyridinyl)butan-1-ol

C15H25NO3 — CID 116752280

IUPAC2-ethoxy-2-methyl-1-(5-propan-2-yloxy-3-pyridinyl)butan-1-ol
SMILESCCOC(C)(CC)C(O)c1cncc(OC(C)C)c1
InChIInChI=1S/C15H25NO3/c1-6-15(5,18-7-2)14(17)12-8-13(10-16-9-12)19-11(3)4/h8-11,14,17H,6-7H2,1-5H3
InChIKeyVEIRTIJPDSJQEQ-UHFFFAOYSA-N
MW267.37 g/mol
LogP3.11
Rot. Bonds7

About 2-ethoxy-2-methyl-1-(5-propan-2-yloxy-3-pyridinyl)butan-1-ol

2-ethoxy-2-methyl-1-(5-propan-2-yloxy-3-pyridinyl)butan-1-ol (PubChem CID 116752280) has the molecular formula C15H25NO3 and a molecular weight of 267.37 g/mol. Its IUPAC name is 2-ethoxy-2-methyl-1-(5-propan-2-yloxy-3-pyridinyl)butan-1-ol.

Molecular Properties

Compound Name2-ethoxy-2-methyl-1-(5-propan-2-yloxy-3-pyridinyl)butan-1-ol
PubChem CID116752280
Molecular FormulaC15H25NO3
Molecular Weight267.37 g/mol
Exact Mass267.18
IUPAC Name2-ethoxy-2-methyl-1-(5-propan-2-yloxy-3-pyridinyl)butan-1-ol
SMILESCCOC(C)(CC)C(O)c1cncc(OC(C)C)c1
InChIInChI=1S/C15H25NO3/c1-6-15(5,18-7-2)14(17)12-8-13(10-16-9-12)19-11(3)4/h8-11,14,17H,6-7H2,1-5H3
InChIKeyVEIRTIJPDSJQEQ-UHFFFAOYSA-N
XLogP3.11
TPSA51.58 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-ethoxy-1-(5-methoxy-3-pyridinyl)-2-methylbutan-1-amine
CID 116758508
2-ethoxy-2-methyl-1-(5-propoxy-3-pyridinyl)butan-1-amine
CID 116758579
3,5,5-trimethyl-1-(5-propan-2-yloxy-3-pyridinyl)hexan-1-ol
CID 115829422
2-ethoxy-3,3-dimethyl-1-(5-propan-2-yloxy-3-pyridinyl)butan-1-amine
CID 116725313
N-ethyl-2-[(2-methylpropan-2-yl)oxy]-1-(5-propan-2-yloxy-3-pyridinyl)ethanamine
CID 105176094
1-(5-fluoro-3-pyridinyl)-2-methoxy-2-methylbutan-1-ol
CID 116751826
2-ethoxy-2-methyl-1-(6-methyl-3-pyridinyl)butan-1-ol
CID 116752175
1-hydrazinyl-N,N,2-trimethyl-1-(5-propan-2-yloxy-3-pyridinyl)butan-2-amine
CID 105240684
[3,3-dimethyl-1-(5-propan-2-yloxy-3-pyridinyl)butyl]hydrazine
CID 105220430
3-cyclohexyl-1-(5-propan-2-yloxy-3-pyridinyl)propan-1-ol
CID 115829399
2-ethoxy-2-ethyl-1-(4-propan-2-yloxyphenyl)butan-1-ol
CID 116752665
2-(1,3-dioxolan-2-yl)-1-(5-propan-2-yloxy-3-pyridinyl)ethanol
CID 103547597

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-2-methyl-1-(5-propan-2-yloxy-3-pyridinyl)butan-1-ol?
The IUPAC name of 2-ethoxy-2-methyl-1-(5-propan-2-yloxy-3-pyridinyl)butan-1-ol (CID 116752280) is 2-ethoxy-2-methyl-1-(5-propan-2-yloxy-3-pyridinyl)butan-1-ol.
What is the SMILES notation for 2-ethoxy-2-methyl-1-(5-propan-2-yloxy-3-pyridinyl)butan-1-ol?
The canonical SMILES for 2-ethoxy-2-methyl-1-(5-propan-2-yloxy-3-pyridinyl)butan-1-ol is CCOC(C)(CC)C(O)c1cncc(OC(C)C)c1.
What is the InChIKey of 2-ethoxy-2-methyl-1-(5-propan-2-yloxy-3-pyridinyl)butan-1-ol?
The InChIKey is VEIRTIJPDSJQEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO3/c1-6-15(5,18-7-2)14(17)12-8-13(10-16-9-12)19-11(3)4/h8-11,14,17H,6-7H2,1-5H3.
What are the key properties of 2-ethoxy-2-methyl-1-(5-propan-2-yloxy-3-pyridinyl)butan-1-ol?
2-ethoxy-2-methyl-1-(5-propan-2-yloxy-3-pyridinyl)butan-1-ol has a molecular weight of 267.37 g/mol, XLogP of 3.11, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-2-methyl-1-(5-propan-2-yloxy-3-pyridinyl)butan-1-ol is sourced from PubChem (CID 116752280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).