[2-(2-propan-2-ylphenoxy)-3-pyridinyl]methanol

C15H17NO2 — CID 61255036

IUPAC[2-(2-propan-2-ylphenoxy)-3-pyridinyl]methanol
SMILESCC(C)c1ccccc1Oc1ncccc1CO
InChIInChI=1S/C15H17NO2/c1-11(2)13-7-3-4-8-14(13)18-15-12(10-17)6-5-9-16-15/h3-9,11,17H,10H2,1-2H3
InChIKeyQTEJQVJFPKTYCT-UHFFFAOYSA-N
MW243.31 g/mol
LogP3.49
Rot. Bonds4

About [2-(2-propan-2-ylphenoxy)-3-pyridinyl]methanol

[2-(2-propan-2-ylphenoxy)-3-pyridinyl]methanol (PubChem CID 61255036) has the molecular formula C15H17NO2 and a molecular weight of 243.31 g/mol. Its IUPAC name is [2-(2-propan-2-ylphenoxy)-3-pyridinyl]methanol.

Molecular Properties

Compound Name[2-(2-propan-2-ylphenoxy)-3-pyridinyl]methanol
PubChem CID61255036
Molecular FormulaC15H17NO2
Molecular Weight243.31 g/mol
Exact Mass243.13
IUPAC Name[2-(2-propan-2-ylphenoxy)-3-pyridinyl]methanol
SMILESCC(C)c1ccccc1Oc1ncccc1CO
InChIInChI=1S/C15H17NO2/c1-11(2)13-7-3-4-8-14(13)18-15-12(10-17)6-5-9-16-15/h3-9,11,17H,10H2,1-2H3
InChIKeyQTEJQVJFPKTYCT-UHFFFAOYSA-N
XLogP3.49
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(chloromethyl)-2-(2-propan-2-ylphenoxy)pyridine
CID 61268632
[2-[2-(hydroxymethyl)phenoxy]-3-pyridinyl]methanol
CID 63653116
[3-fluoro-2-(2-propan-2-ylphenoxy)-4-pyridinyl]methanol
CID 105383273
[2-(2-ethylphenoxy)-3-pyridinyl]methanol
CID 61257757
[4-(2-propan-2-ylphenoxy)pyrimidin-5-yl]methanol
CID 114215255
[2-(2-bromophenoxy)-3-pyridinyl]methanol
CID 61256696
[2-(2-tert-butylphenoxy)-3-pyridinyl]methanol
CID 61255865
[2-[(3-methyl-2-pyridinyl)oxy]phenyl]methanol
CID 107713381
[2-(2,4-difluorophenoxy)-3-pyridinyl]methanol
CID 61256286
2-(2-propan-2-ylphenoxy)pyridine-3-sulfonyl chloride
CID 115928434
1-[2-(2-butan-2-ylphenoxy)-3-pyridinyl]-N-methylmethanamine
CID 62322019
[2-(3-aminopyrazin-2-yl)oxyphenyl]methanol
CID 102988200

Frequently Asked Questions

What is the IUPAC name of [2-(2-propan-2-ylphenoxy)-3-pyridinyl]methanol?
The IUPAC name of [2-(2-propan-2-ylphenoxy)-3-pyridinyl]methanol (CID 61255036) is [2-(2-propan-2-ylphenoxy)-3-pyridinyl]methanol.
What is the SMILES notation for [2-(2-propan-2-ylphenoxy)-3-pyridinyl]methanol?
The canonical SMILES for [2-(2-propan-2-ylphenoxy)-3-pyridinyl]methanol is CC(C)c1ccccc1Oc1ncccc1CO.
What is the InChIKey of [2-(2-propan-2-ylphenoxy)-3-pyridinyl]methanol?
The InChIKey is QTEJQVJFPKTYCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO2/c1-11(2)13-7-3-4-8-14(13)18-15-12(10-17)6-5-9-16-15/h3-9,11,17H,10H2,1-2H3.
What are the key properties of [2-(2-propan-2-ylphenoxy)-3-pyridinyl]methanol?
[2-(2-propan-2-ylphenoxy)-3-pyridinyl]methanol has a molecular weight of 243.31 g/mol, XLogP of 3.49, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-propan-2-ylphenoxy)-3-pyridinyl]methanol is sourced from PubChem (CID 61255036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).