1-[3-methoxy-4-[(5-methyl-3-pyridinyl)methoxy]phenyl]ethanol

C16H19NO3 — CID 102881584

IUPAC1-[3-methoxy-4-[(5-methyl-3-pyridinyl)methoxy]phenyl]ethanol
SMILESCOc1cc(C(C)O)ccc1OCc1cncc(C)c1
InChIInChI=1S/C16H19NO3/c1-11-6-13(9-17-8-11)10-20-15-5-4-14(12(2)18)7-16(15)19-3/h4-9,12,18H,10H2,1-3H3
InChIKeyUDZHYMRTPDWUPA-UHFFFAOYSA-N
MW273.33 g/mol
LogP3.03
Rot. Bonds5

About 1-[3-methoxy-4-[(5-methyl-3-pyridinyl)methoxy]phenyl]ethanol

1-[3-methoxy-4-[(5-methyl-3-pyridinyl)methoxy]phenyl]ethanol (PubChem CID 102881584) has the molecular formula C16H19NO3 and a molecular weight of 273.33 g/mol. Its IUPAC name is 1-[3-methoxy-4-[(5-methyl-3-pyridinyl)methoxy]phenyl]ethanol.

Molecular Properties

Compound Name1-[3-methoxy-4-[(5-methyl-3-pyridinyl)methoxy]phenyl]ethanol
PubChem CID102881584
Molecular FormulaC16H19NO3
Molecular Weight273.33 g/mol
Exact Mass273.14
IUPAC Name1-[3-methoxy-4-[(5-methyl-3-pyridinyl)methoxy]phenyl]ethanol
SMILESCOc1cc(C(C)O)ccc1OCc1cncc(C)c1
InChIInChI=1S/C16H19NO3/c1-11-6-13(9-17-8-11)10-20-15-5-4-14(12(2)18)7-16(15)19-3/h4-9,12,18H,10H2,1-3H3
InChIKeyUDZHYMRTPDWUPA-UHFFFAOYSA-N
XLogP3.03
TPSA51.58 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.33
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(1R)-1-[4-[(5-bromo-3-pyridinyl)methoxy]-3-methoxyphenyl]ethanol
CID 104798690
1-[3-chloro-4-[(5-methyl-3-pyridinyl)methoxy]phenyl]ethanol
CID 102881647
(1R)-1-[3-fluoro-4-[(5-methyl-3-pyridinyl)methoxy]phenyl]ethanol
CID 102881645
(1S)-1-(3-methoxy-4-phenylmethoxyphenyl)ethanol
CID 63364701
(1R)-1-[4-[(4-chlorophenyl)methoxy]-3-methoxyphenyl]ethanol
CID 78931221
3-methoxy-4-[(5-methyl-3-pyridinyl)methoxy]benzonitrile
CID 102881171
(1S)-1-[4-bromo-2-[(5-methyl-3-pyridinyl)methoxy]phenyl]ethanol
CID 102949293
1-[4-methoxy-3-[(5-methyl-3-pyridinyl)methoxy]phenyl]propan-2-amine
CID 102878176
(1R)-1-[4-[(3-fluorophenyl)methoxy]-3-methoxyphenyl]ethanol
CID 78931656
(1S)-1-[3-methoxy-4-[(5-methyl-1,2-oxazol-3-yl)methoxy]phenyl]ethanol
CID 78931662
(1R)-1-[3-methoxy-4-(methoxymethoxy)phenyl]ethanol
CID 65364454
1-[3-methoxy-4-(1,3-thiazol-4-ylmethoxy)phenyl]ethanol
CID 43503800

Frequently Asked Questions

What is the IUPAC name of 1-[3-methoxy-4-[(5-methyl-3-pyridinyl)methoxy]phenyl]ethanol?
The IUPAC name of 1-[3-methoxy-4-[(5-methyl-3-pyridinyl)methoxy]phenyl]ethanol (CID 102881584) is 1-[3-methoxy-4-[(5-methyl-3-pyridinyl)methoxy]phenyl]ethanol.
What is the SMILES notation for 1-[3-methoxy-4-[(5-methyl-3-pyridinyl)methoxy]phenyl]ethanol?
The canonical SMILES for 1-[3-methoxy-4-[(5-methyl-3-pyridinyl)methoxy]phenyl]ethanol is COc1cc(C(C)O)ccc1OCc1cncc(C)c1.
What is the InChIKey of 1-[3-methoxy-4-[(5-methyl-3-pyridinyl)methoxy]phenyl]ethanol?
The InChIKey is UDZHYMRTPDWUPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO3/c1-11-6-13(9-17-8-11)10-20-15-5-4-14(12(2)18)7-16(15)19-3/h4-9,12,18H,10H2,1-3H3.
What are the key properties of 1-[3-methoxy-4-[(5-methyl-3-pyridinyl)methoxy]phenyl]ethanol?
1-[3-methoxy-4-[(5-methyl-3-pyridinyl)methoxy]phenyl]ethanol has a molecular weight of 273.33 g/mol, XLogP of 3.03, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-methoxy-4-[(5-methyl-3-pyridinyl)methoxy]phenyl]ethanol is sourced from PubChem (CID 102881584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).