(2-ethoxy-6-propan-2-yloxy-4-pyridinyl)methanol

C11H17NO3 — CID 130406900

IUPAC(2-ethoxy-6-propan-2-yloxy-4-pyridinyl)methanol
SMILESCCOc1cc(CO)cc(OC(C)C)n1
InChIInChI=1S/C11H17NO3/c1-4-14-10-5-9(7-13)6-11(12-10)15-8(2)3/h5-6,8,13H,4,7H2,1-3H3
InChIKeyXBMJZVRUPJAYON-UHFFFAOYSA-N
MW211.26 g/mol
LogP1.76
Rot. Bonds5

About (2-ethoxy-6-propan-2-yloxy-4-pyridinyl)methanol

(2-ethoxy-6-propan-2-yloxy-4-pyridinyl)methanol (PubChem CID 130406900) has the molecular formula C11H17NO3 and a molecular weight of 211.26 g/mol. Its IUPAC name is (2-ethoxy-6-propan-2-yloxy-4-pyridinyl)methanol.

Molecular Properties

Compound Name(2-ethoxy-6-propan-2-yloxy-4-pyridinyl)methanol
PubChem CID130406900
Molecular FormulaC11H17NO3
Molecular Weight211.26 g/mol
Exact Mass211.12
IUPAC Name(2-ethoxy-6-propan-2-yloxy-4-pyridinyl)methanol
SMILESCCOc1cc(CO)cc(OC(C)C)n1
InChIInChI=1S/C11H17NO3/c1-4-14-10-5-9(7-13)6-11(12-10)15-8(2)3/h5-6,8,13H,4,7H2,1-3H3
InChIKeyXBMJZVRUPJAYON-UHFFFAOYSA-N
XLogP1.76
TPSA51.58 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2-ethoxy-6-propan-2-yloxy-4-pyridinyl)methanol?
The IUPAC name of (2-ethoxy-6-propan-2-yloxy-4-pyridinyl)methanol (CID 130406900) is (2-ethoxy-6-propan-2-yloxy-4-pyridinyl)methanol.
What is the SMILES notation for (2-ethoxy-6-propan-2-yloxy-4-pyridinyl)methanol?
The canonical SMILES for (2-ethoxy-6-propan-2-yloxy-4-pyridinyl)methanol is CCOc1cc(CO)cc(OC(C)C)n1.
What is the InChIKey of (2-ethoxy-6-propan-2-yloxy-4-pyridinyl)methanol?
The InChIKey is XBMJZVRUPJAYON-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO3/c1-4-14-10-5-9(7-13)6-11(12-10)15-8(2)3/h5-6,8,13H,4,7H2,1-3H3.
What are the key properties of (2-ethoxy-6-propan-2-yloxy-4-pyridinyl)methanol?
(2-ethoxy-6-propan-2-yloxy-4-pyridinyl)methanol has a molecular weight of 211.26 g/mol, XLogP of 1.76, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethoxy-6-propan-2-yloxy-4-pyridinyl)methanol is sourced from PubChem (CID 130406900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).