1-(2-ethoxy-6-propan-2-yloxy-4-pyridinyl)butan-2-ol

C14H23NO3 — CID 145366896

IUPAC1-(2-ethoxy-6-propan-2-yloxy-4-pyridinyl)butan-2-ol
SMILESCCOc1cc(CC(O)CC)cc(OC(C)C)n1
InChIInChI=1S/C14H23NO3/c1-5-12(16)7-11-8-13(17-6-2)15-14(9-11)18-10(3)4/h8-10,12,16H,5-7H2,1-4H3
InChIKeyPPATXCGLAZRTRR-UHFFFAOYSA-N
MW253.34 g/mol
LogP2.58
Rot. Bonds7

About 1-(2-ethoxy-6-propan-2-yloxy-4-pyridinyl)butan-2-ol

1-(2-ethoxy-6-propan-2-yloxy-4-pyridinyl)butan-2-ol (PubChem CID 145366896) has the molecular formula C14H23NO3 and a molecular weight of 253.34 g/mol. Its IUPAC name is 1-(2-ethoxy-6-propan-2-yloxy-4-pyridinyl)butan-2-ol.

Molecular Properties

Compound Name1-(2-ethoxy-6-propan-2-yloxy-4-pyridinyl)butan-2-ol
PubChem CID145366896
Molecular FormulaC14H23NO3
Molecular Weight253.34 g/mol
Exact Mass253.17
IUPAC Name1-(2-ethoxy-6-propan-2-yloxy-4-pyridinyl)butan-2-ol
SMILESCCOc1cc(CC(O)CC)cc(OC(C)C)n1
InChIInChI=1S/C14H23NO3/c1-5-12(16)7-11-8-13(17-6-2)15-14(9-11)18-10(3)4/h8-10,12,16H,5-7H2,1-4H3
InChIKeyPPATXCGLAZRTRR-UHFFFAOYSA-N
XLogP2.58
TPSA51.58 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.34
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2-ethoxy-6-methoxy-4-pyridinyl)butan-2-ol
CID 145366870
(2-ethoxy-6-propan-2-yloxy-4-pyridinyl)methanol
CID 130406900
1-(4-ethoxyphenyl)butan-2-ol
CID 82161585
2-ethoxy-6-propan-2-yloxypyridine-3-carboxylic acid
CID 175541249
1-(3,5-dichlorophenyl)butan-2-ol
CID 71163653
4-methoxy-2-propan-2-yloxy-6-(2,2,2-trifluoroethoxy)pyridine
CID 155716665
3-(6-ethoxy-2-methylpyrimidin-4-yl)butan-2-ol
CID 66331506
1,3-diethoxy-5-(2-methylpropyl)-2-propan-2-yloxybenzene
CID 135280827
2-[butan-2-yl-(4-ethoxy-6-methylpyrimidin-2-yl)amino]acetic acid
CID 112634398
4-[2-methoxy-2-[1-methoxy-2-(2-propan-2-yloxy-4-pyridinyl)ethoxy]ethyl]-2-propan-2-yloxypyridine
CID 69013905
(2R)-1-pyridin-4-ylbutan-2-ol
CID 94470888
2-(6-propan-2-yloxypyrimidin-4-yl)butanoic acid
CID 104572083

Frequently Asked Questions

What is the IUPAC name of 1-(2-ethoxy-6-propan-2-yloxy-4-pyridinyl)butan-2-ol?
The IUPAC name of 1-(2-ethoxy-6-propan-2-yloxy-4-pyridinyl)butan-2-ol (CID 145366896) is 1-(2-ethoxy-6-propan-2-yloxy-4-pyridinyl)butan-2-ol.
What is the SMILES notation for 1-(2-ethoxy-6-propan-2-yloxy-4-pyridinyl)butan-2-ol?
The canonical SMILES for 1-(2-ethoxy-6-propan-2-yloxy-4-pyridinyl)butan-2-ol is CCOc1cc(CC(O)CC)cc(OC(C)C)n1.
What is the InChIKey of 1-(2-ethoxy-6-propan-2-yloxy-4-pyridinyl)butan-2-ol?
The InChIKey is PPATXCGLAZRTRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO3/c1-5-12(16)7-11-8-13(17-6-2)15-14(9-11)18-10(3)4/h8-10,12,16H,5-7H2,1-4H3.
What are the key properties of 1-(2-ethoxy-6-propan-2-yloxy-4-pyridinyl)butan-2-ol?
1-(2-ethoxy-6-propan-2-yloxy-4-pyridinyl)butan-2-ol has a molecular weight of 253.34 g/mol, XLogP of 2.58, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethoxy-6-propan-2-yloxy-4-pyridinyl)butan-2-ol is sourced from PubChem (CID 145366896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).