(4-propan-2-ylphenyl)-pyridin-3-ylmethanol

C15H17NO — CID 13282975

IUPAC(4-propan-2-ylphenyl)-pyridin-3-ylmethanol
SMILESCC(C)c1ccc(C(O)c2cccnc2)cc1
InChIInChI=1S/C15H17NO/c1-11(2)12-5-7-13(8-6-12)15(17)14-4-3-9-16-10-14/h3-11,15,17H,1-2H3
InChIKeyXVNAPWUCSVIPIL-UHFFFAOYSA-N
MW227.31 g/mol
LogP3.29
Rot. Bonds3

About (4-propan-2-ylphenyl)-pyridin-3-ylmethanol

(4-propan-2-ylphenyl)-pyridin-3-ylmethanol (PubChem CID 13282975) has the molecular formula C15H17NO and a molecular weight of 227.31 g/mol. Its IUPAC name is (4-propan-2-ylphenyl)-pyridin-3-ylmethanol.

Molecular Properties

Compound Name(4-propan-2-ylphenyl)-pyridin-3-ylmethanol
PubChem CID13282975
Molecular FormulaC15H17NO
Molecular Weight227.31 g/mol
Exact Mass227.13
IUPAC Name(4-propan-2-ylphenyl)-pyridin-3-ylmethanol
SMILESCC(C)c1ccc(C(O)c2cccnc2)cc1
InChIInChI=1S/C15H17NO/c1-11(2)12-5-7-13(8-6-12)15(17)14-4-3-9-16-10-14/h3-11,15,17H,1-2H3
InChIKeyXVNAPWUCSVIPIL-UHFFFAOYSA-N
XLogP3.29
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (4-propan-2-ylphenyl)-pyridin-3-ylmethanol?
The IUPAC name of (4-propan-2-ylphenyl)-pyridin-3-ylmethanol (CID 13282975) is (4-propan-2-ylphenyl)-pyridin-3-ylmethanol.
What is the SMILES notation for (4-propan-2-ylphenyl)-pyridin-3-ylmethanol?
The canonical SMILES for (4-propan-2-ylphenyl)-pyridin-3-ylmethanol is CC(C)c1ccc(C(O)c2cccnc2)cc1.
What is the InChIKey of (4-propan-2-ylphenyl)-pyridin-3-ylmethanol?
The InChIKey is XVNAPWUCSVIPIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO/c1-11(2)12-5-7-13(8-6-12)15(17)14-4-3-9-16-10-14/h3-11,15,17H,1-2H3.
What are the key properties of (4-propan-2-ylphenyl)-pyridin-3-ylmethanol?
(4-propan-2-ylphenyl)-pyridin-3-ylmethanol has a molecular weight of 227.31 g/mol, XLogP of 3.29, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-propan-2-ylphenyl)-pyridin-3-ylmethanol is sourced from PubChem (CID 13282975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).