[4-methoxy-2-(2-pyridin-4-ylethoxy)phenyl]methanol

C15H17NO3 — CID 61268316

IUPAC[4-methoxy-2-(2-pyridin-4-ylethoxy)phenyl]methanol
SMILESCOc1ccc(CO)c(OCCc2ccncc2)c1
InChIInChI=1S/C15H17NO3/c1-18-14-3-2-13(11-17)15(10-14)19-9-6-12-4-7-16-8-5-12/h2-5,7-8,10,17H,6,9,11H2,1H3
InChIKeyMNUZQZAWNVBRIE-UHFFFAOYSA-N
MW259.31 g/mol
LogP2.20
Rot. Bonds6

About [4-methoxy-2-(2-pyridin-4-ylethoxy)phenyl]methanol

[4-methoxy-2-(2-pyridin-4-ylethoxy)phenyl]methanol (PubChem CID 61268316) has the molecular formula C15H17NO3 and a molecular weight of 259.31 g/mol. Its IUPAC name is [4-methoxy-2-(2-pyridin-4-ylethoxy)phenyl]methanol.

Molecular Properties

Compound Name[4-methoxy-2-(2-pyridin-4-ylethoxy)phenyl]methanol
PubChem CID61268316
Molecular FormulaC15H17NO3
Molecular Weight259.31 g/mol
Exact Mass259.12
IUPAC Name[4-methoxy-2-(2-pyridin-4-ylethoxy)phenyl]methanol
SMILESCOc1ccc(CO)c(OCCc2ccncc2)c1
InChIInChI=1S/C15H17NO3/c1-18-14-3-2-13(11-17)15(10-14)19-9-6-12-4-7-16-8-5-12/h2-5,7-8,10,17H,6,9,11H2,1H3
InChIKeyMNUZQZAWNVBRIE-UHFFFAOYSA-N
XLogP2.20
TPSA51.58 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [4-methoxy-2-(2-pyridin-4-ylethoxy)phenyl]methanol?
The IUPAC name of [4-methoxy-2-(2-pyridin-4-ylethoxy)phenyl]methanol (CID 61268316) is [4-methoxy-2-(2-pyridin-4-ylethoxy)phenyl]methanol.
What is the SMILES notation for [4-methoxy-2-(2-pyridin-4-ylethoxy)phenyl]methanol?
The canonical SMILES for [4-methoxy-2-(2-pyridin-4-ylethoxy)phenyl]methanol is COc1ccc(CO)c(OCCc2ccncc2)c1.
What is the InChIKey of [4-methoxy-2-(2-pyridin-4-ylethoxy)phenyl]methanol?
The InChIKey is MNUZQZAWNVBRIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO3/c1-18-14-3-2-13(11-17)15(10-14)19-9-6-12-4-7-16-8-5-12/h2-5,7-8,10,17H,6,9,11H2,1H3.
What are the key properties of [4-methoxy-2-(2-pyridin-4-ylethoxy)phenyl]methanol?
[4-methoxy-2-(2-pyridin-4-ylethoxy)phenyl]methanol has a molecular weight of 259.31 g/mol, XLogP of 2.20, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-methoxy-2-(2-pyridin-4-ylethoxy)phenyl]methanol is sourced from PubChem (CID 61268316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).