[6-(2-tert-butyl-5-methylphenoxy)-2-pyridinyl]methanol

C17H21NO2 — CID 62253773

IUPAC[6-(2-tert-butyl-5-methylphenoxy)-2-pyridinyl]methanol
SMILESCc1ccc(C(C)(C)C)c(Oc2cccc(CO)n2)c1
InChIInChI=1S/C17H21NO2/c1-12-8-9-14(17(2,3)4)15(10-12)20-16-7-5-6-13(11-19)18-16/h5-10,19H,11H2,1-4H3
InChIKeyXHIZUIQDNPFXOI-UHFFFAOYSA-N
MW271.36 g/mol
LogP3.97
Rot. Bonds3

About [6-(2-tert-butyl-5-methylphenoxy)-2-pyridinyl]methanol

[6-(2-tert-butyl-5-methylphenoxy)-2-pyridinyl]methanol (PubChem CID 62253773) has the molecular formula C17H21NO2 and a molecular weight of 271.36 g/mol. Its IUPAC name is [6-(2-tert-butyl-5-methylphenoxy)-2-pyridinyl]methanol.

Molecular Properties

Compound Name[6-(2-tert-butyl-5-methylphenoxy)-2-pyridinyl]methanol
PubChem CID62253773
Molecular FormulaC17H21NO2
Molecular Weight271.36 g/mol
Exact Mass271.16
IUPAC Name[6-(2-tert-butyl-5-methylphenoxy)-2-pyridinyl]methanol
SMILESCc1ccc(C(C)(C)C)c(Oc2cccc(CO)n2)c1
InChIInChI=1S/C17H21NO2/c1-12-8-9-14(17(2,3)4)15(10-12)20-16-7-5-6-13(11-19)18-16/h5-10,19H,11H2,1-4H3
InChIKeyXHIZUIQDNPFXOI-UHFFFAOYSA-N
XLogP3.97
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[5-(2-tert-butyl-5-methylphenoxy)pyrazin-2-yl]methanol
CID 107373044
[6-(4-methylphenoxy)-2-pyridinyl]methanol
CID 62253967
4-(2-tert-butyl-5-methylphenoxy)-2-chloro-6-methylpyrimidine
CID 63506097
[6-(2,4-dichlorophenoxy)-2-pyridinyl]methanol
CID 62240040
[6-[2-(trifluoromethyl)phenoxy]-2-pyridinyl]methanol
CID 55053126
6-(2-tert-butyl-5-methylphenoxy)-N-ethylpyrimidin-4-amine
CID 80864924
2-(chloromethyl)-6-(2-chloro-5-methylphenoxy)pyridine
CID 62239031
[6-(2-ethylphenoxy)-2-pyridinyl]methanol
CID 62240045
[6-(2-tert-butyl-4-methoxyphenoxy)-2-pyridinyl]methanamine
CID 62298299
3-(2-tert-butyl-5-methylphenoxy)aniline
CID 80752414
1-tert-butyl-2-[3-chloro-2-(chloromethyl)phenoxy]-4-methylbenzene
CID 63565889
[6-(3,3-dimethylbutoxy)-2-pyridinyl]methanol
CID 66234998

Frequently Asked Questions

What is the IUPAC name of [6-(2-tert-butyl-5-methylphenoxy)-2-pyridinyl]methanol?
The IUPAC name of [6-(2-tert-butyl-5-methylphenoxy)-2-pyridinyl]methanol (CID 62253773) is [6-(2-tert-butyl-5-methylphenoxy)-2-pyridinyl]methanol.
What is the SMILES notation for [6-(2-tert-butyl-5-methylphenoxy)-2-pyridinyl]methanol?
The canonical SMILES for [6-(2-tert-butyl-5-methylphenoxy)-2-pyridinyl]methanol is Cc1ccc(C(C)(C)C)c(Oc2cccc(CO)n2)c1.
What is the InChIKey of [6-(2-tert-butyl-5-methylphenoxy)-2-pyridinyl]methanol?
The InChIKey is XHIZUIQDNPFXOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NO2/c1-12-8-9-14(17(2,3)4)15(10-12)20-16-7-5-6-13(11-19)18-16/h5-10,19H,11H2,1-4H3.
What are the key properties of [6-(2-tert-butyl-5-methylphenoxy)-2-pyridinyl]methanol?
[6-(2-tert-butyl-5-methylphenoxy)-2-pyridinyl]methanol has a molecular weight of 271.36 g/mol, XLogP of 3.97, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(2-tert-butyl-5-methylphenoxy)-2-pyridinyl]methanol is sourced from PubChem (CID 62253773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).