1-[4-[(3-methyl-2-pyridinyl)methoxy]phenyl]propan-2-ol

C16H19NO2 — CID 112650663

IUPAC1-[4-[(3-methyl-2-pyridinyl)methoxy]phenyl]propan-2-ol
SMILESCc1cccnc1COc1ccc(CC(C)O)cc1
InChIInChI=1S/C16H19NO2/c1-12-4-3-9-17-16(12)11-19-15-7-5-14(6-8-15)10-13(2)18/h3-9,13,18H,10-11H2,1-2H3
InChIKeyUQXQGWYUEBROTN-UHFFFAOYSA-N
MW257.33 g/mol
LogP2.89
Rot. Bonds5

About 1-[4-[(3-methyl-2-pyridinyl)methoxy]phenyl]propan-2-ol

1-[4-[(3-methyl-2-pyridinyl)methoxy]phenyl]propan-2-ol (PubChem CID 112650663) has the molecular formula C16H19NO2 and a molecular weight of 257.33 g/mol. Its IUPAC name is 1-[4-[(3-methyl-2-pyridinyl)methoxy]phenyl]propan-2-ol.

Molecular Properties

Compound Name1-[4-[(3-methyl-2-pyridinyl)methoxy]phenyl]propan-2-ol
PubChem CID112650663
Molecular FormulaC16H19NO2
Molecular Weight257.33 g/mol
Exact Mass257.14
IUPAC Name1-[4-[(3-methyl-2-pyridinyl)methoxy]phenyl]propan-2-ol
SMILESCc1cccnc1COc1ccc(CC(C)O)cc1
InChIInChI=1S/C16H19NO2/c1-12-4-3-9-17-16(12)11-19-15-7-5-14(6-8-15)10-13(2)18/h3-9,13,18H,10-11H2,1-2H3
InChIKeyUQXQGWYUEBROTN-UHFFFAOYSA-N
XLogP2.89
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 ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[4-[(3-methyl-2-pyridinyl)methoxy]phenyl]butan-2-ol
CID 115982097
N-ethyl-1-[4-[(3-methyl-2-pyridinyl)methoxy]phenyl]propan-2-amine
CID 115981835
1-[4-[(2-methylphenyl)methoxy]phenyl]propan-2-ol
CID 115496013
2-methyl-N-[[4-[(3-methyl-2-pyridinyl)methoxy]phenyl]methyl]propan-1-amine
CID 115981790
2-[4-[(3-methyl-2-pyridinyl)methoxy]phenyl]acetonitrile
CID 112650342
1-[4-(pyridin-4-ylmethoxy)phenyl]propan-2-ol
CID 113323114
1-[4-(4-phenylmethoxyphenyl)phenyl]propan-2-ol
CID 18927881
3-methyl-2-[(3-methyl-2-pyridinyl)methoxymethyl]pyridine
CID 142776988
3-methyl-2-[[4-(2-pyridin-4-ylphenyl)phenoxy]methyl]pyridine
CID 67026425
1-[4-(thiophen-2-ylmethoxy)phenyl]propan-2-ol
CID 115496016
(1R)-1-[2-fluoro-4-[(3-methyl-2-pyridinyl)methoxy]phenyl]ethanamine
CID 107718507
3-methyl-2-[(2S)-2-(2-methylphenyl)propyl]pyridine
CID 165410451

Frequently Asked Questions

What is the IUPAC name of 1-[4-[(3-methyl-2-pyridinyl)methoxy]phenyl]propan-2-ol?
The IUPAC name of 1-[4-[(3-methyl-2-pyridinyl)methoxy]phenyl]propan-2-ol (CID 112650663) is 1-[4-[(3-methyl-2-pyridinyl)methoxy]phenyl]propan-2-ol.
What is the SMILES notation for 1-[4-[(3-methyl-2-pyridinyl)methoxy]phenyl]propan-2-ol?
The canonical SMILES for 1-[4-[(3-methyl-2-pyridinyl)methoxy]phenyl]propan-2-ol is Cc1cccnc1COc1ccc(CC(C)O)cc1.
What is the InChIKey of 1-[4-[(3-methyl-2-pyridinyl)methoxy]phenyl]propan-2-ol?
The InChIKey is UQXQGWYUEBROTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO2/c1-12-4-3-9-17-16(12)11-19-15-7-5-14(6-8-15)10-13(2)18/h3-9,13,18H,10-11H2,1-2H3.
What are the key properties of 1-[4-[(3-methyl-2-pyridinyl)methoxy]phenyl]propan-2-ol?
1-[4-[(3-methyl-2-pyridinyl)methoxy]phenyl]propan-2-ol has a molecular weight of 257.33 g/mol, XLogP of 2.89, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[(3-methyl-2-pyridinyl)methoxy]phenyl]propan-2-ol is sourced from PubChem (CID 112650663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).