[2-[4-(1-ethoxyethyl)phenyl]-4-pyridinyl]methanol

C16H19NO2 — CID 50975061

IUPAC[2-[4-(1-ethoxyethyl)phenyl]-4-pyridinyl]methanol
SMILESCCOC(C)c1ccc(-c2cc(CO)ccn2)cc1
InChIInChI=1S/C16H19NO2/c1-3-19-12(2)14-4-6-15(7-5-14)16-10-13(11-18)8-9-17-16/h4-10,12,18H,3,11H2,1-2H3
InChIKeyJWXDYCKTAZKQPW-UHFFFAOYSA-N
MW257.33 g/mol
LogP3.34
Rot. Bonds5

About [2-[4-(1-ethoxyethyl)phenyl]-4-pyridinyl]methanol

[2-[4-(1-ethoxyethyl)phenyl]-4-pyridinyl]methanol (PubChem CID 50975061) has the molecular formula C16H19NO2 and a molecular weight of 257.33 g/mol. Its IUPAC name is [2-[4-(1-ethoxyethyl)phenyl]-4-pyridinyl]methanol.

Molecular Properties

Compound Name[2-[4-(1-ethoxyethyl)phenyl]-4-pyridinyl]methanol
PubChem CID50975061
Molecular FormulaC16H19NO2
Molecular Weight257.33 g/mol
Exact Mass257.14
IUPAC Name[2-[4-(1-ethoxyethyl)phenyl]-4-pyridinyl]methanol
SMILESCCOC(C)c1ccc(-c2cc(CO)ccn2)cc1
InChIInChI=1S/C16H19NO2/c1-3-19-12(2)14-4-6-15(7-5-14)16-10-13(11-18)8-9-17-16/h4-10,12,18H,3,11H2,1-2H3
InChIKeyJWXDYCKTAZKQPW-UHFFFAOYSA-N
XLogP3.34
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.33
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Doxylamine
CID 3162
Phenyl(pyridin-3-yl)methanol
CID 234839
alpha-Phenyl-4-pyridinemethanol
CID 98305
(R)-6-(3-hydroxypropyl)-6-phenyl-3-((S)-1-(4-(pyridin-2-yl)phenyl)ethyl)-1,3-oxazinan-2-one
CID 58109704
2-Morpholin-4-yl-1-phenyl-1-pyridin-2-ylethanol
CID 5303332
(4-Methylphenyl)(4-pyridinyl)methanol
CID 3383504
Doxylamine alcohol
CID 86883
alpha,alpha-Diphenyl-2-pyridineethanol
CID 234268
Phenyl(pyridin-2-yl)methanol
CID 315585
(2-Methylphenyl)(2-pyridinyl)methanol
CID 5143164
(7R,9S)-7-(((3S,4R)-3-methyl-4-o-tolylpiperidin-1-yl)methyl)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-9-ol
CID 11152739
trans-(+)-7-((4-o-tolylpiperidin-1-yl)methyl)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-9-ol
CID 11187225

Frequently Asked Questions

What is the IUPAC name of [2-[4-(1-ethoxyethyl)phenyl]-4-pyridinyl]methanol?
The IUPAC name of [2-[4-(1-ethoxyethyl)phenyl]-4-pyridinyl]methanol (CID 50975061) is [2-[4-(1-ethoxyethyl)phenyl]-4-pyridinyl]methanol.
What is the SMILES notation for [2-[4-(1-ethoxyethyl)phenyl]-4-pyridinyl]methanol?
The canonical SMILES for [2-[4-(1-ethoxyethyl)phenyl]-4-pyridinyl]methanol is CCOC(C)c1ccc(-c2cc(CO)ccn2)cc1.
What is the InChIKey of [2-[4-(1-ethoxyethyl)phenyl]-4-pyridinyl]methanol?
The InChIKey is JWXDYCKTAZKQPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO2/c1-3-19-12(2)14-4-6-15(7-5-14)16-10-13(11-18)8-9-17-16/h4-10,12,18H,3,11H2,1-2H3.
What are the key properties of [2-[4-(1-ethoxyethyl)phenyl]-4-pyridinyl]methanol?
[2-[4-(1-ethoxyethyl)phenyl]-4-pyridinyl]methanol has a molecular weight of 257.33 g/mol, XLogP of 3.34, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[4-(1-ethoxyethyl)phenyl]-4-pyridinyl]methanol is sourced from PubChem (CID 50975061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).