[5-(4-tert-butylphenyl)-2-pyridinyl]methanol

C16H19NO — CID 139170729

IUPAC[5-(4-tert-butylphenyl)-2-pyridinyl]methanol
SMILESCC(C)(C)c1ccc(-c2ccc(CO)nc2)cc1
InChIInChI=1S/C16H19NO/c1-16(2,3)14-7-4-12(5-8-14)13-6-9-15(11-18)17-10-13/h4-10,18H,11H2,1-3H3
InChIKeyYTRQQRWUIYJOBW-UHFFFAOYSA-N
MW241.33 g/mol
LogP3.54
Rot. Bonds2

About [5-(4-tert-butylphenyl)-2-pyridinyl]methanol

[5-(4-tert-butylphenyl)-2-pyridinyl]methanol (PubChem CID 139170729) has the molecular formula C16H19NO and a molecular weight of 241.33 g/mol. Its IUPAC name is [5-(4-tert-butylphenyl)-2-pyridinyl]methanol.

Molecular Properties

Compound Name[5-(4-tert-butylphenyl)-2-pyridinyl]methanol
PubChem CID139170729
Molecular FormulaC16H19NO
Molecular Weight241.33 g/mol
Exact Mass241.15
IUPAC Name[5-(4-tert-butylphenyl)-2-pyridinyl]methanol
SMILESCC(C)(C)c1ccc(-c2ccc(CO)nc2)cc1
InChIInChI=1S/C16H19NO/c1-16(2,3)14-7-4-12(5-8-14)13-6-9-15(11-18)17-10-13/h4-10,18H,11H2,1-3H3
InChIKeyYTRQQRWUIYJOBW-UHFFFAOYSA-N
XLogP3.54
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[5-(3-methylpentan-3-yl)-2-pyridinyl]methanol
CID 155392603
2-phenyl-1-(5-phenyl-2-pyridinyl)propan-2-ol
CID 129158773
5-(4-tert-butylphenyl)-2-methoxypyridine
CID 67097821
[6-(4-tert-butylphenyl)-2-pyridinyl]methanol
CID 22566603
2-methyl-1-(5-phenyl-2-pyridinyl)propan-2-ol
CID 115009058
5-(4-tert-butylphenyl)pyridine-2-carbaldehyde
CID 87526262
(5-methyl-2-pyridinyl)methanol;hydrochloride
CID 91620369
1-(4-tert-butylphenyl)-9-[6-(hydroxymethyl)-3-pyridinyl]pyrimido[5,4-c][1,5]naphthyridine-2,4-dione
CID 163526904
5-tert-butyl-2-[4-(4-tert-butylphenyl)phenyl]pyrimidine;ethane
CID 160558757
5-tert-butyl-2-prop-2-ynylpyridine
CID 135295966
[5-(trifluoromethyl)-2-pyridinyl]methanol sulfate
CID 18983902
6-(hydroxymethyl)pyridin-3-ol;hydrochloride
CID 18758423

Frequently Asked Questions

What is the IUPAC name of [5-(4-tert-butylphenyl)-2-pyridinyl]methanol?
The IUPAC name of [5-(4-tert-butylphenyl)-2-pyridinyl]methanol (CID 139170729) is [5-(4-tert-butylphenyl)-2-pyridinyl]methanol.
What is the SMILES notation for [5-(4-tert-butylphenyl)-2-pyridinyl]methanol?
The canonical SMILES for [5-(4-tert-butylphenyl)-2-pyridinyl]methanol is CC(C)(C)c1ccc(-c2ccc(CO)nc2)cc1.
What is the InChIKey of [5-(4-tert-butylphenyl)-2-pyridinyl]methanol?
The InChIKey is YTRQQRWUIYJOBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO/c1-16(2,3)14-7-4-12(5-8-14)13-6-9-15(11-18)17-10-13/h4-10,18H,11H2,1-3H3.
What are the key properties of [5-(4-tert-butylphenyl)-2-pyridinyl]methanol?
[5-(4-tert-butylphenyl)-2-pyridinyl]methanol has a molecular weight of 241.33 g/mol, XLogP of 3.54, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(4-tert-butylphenyl)-2-pyridinyl]methanol is sourced from PubChem (CID 139170729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).