bis(2,6-dimethyl-3-pyridinyl)methanol

C15H18N2O — CID 141423650

IUPACbis(2,6-dimethyl-3-pyridinyl)methanol
SMILESCc1ccc(C(O)c2ccc(C)nc2C)c(C)n1
InChIInChI=1S/C15H18N2O/c1-9-5-7-13(11(3)16-9)15(18)14-8-6-10(2)17-12(14)4/h5-8,15,18H,1-4H3
InChIKeyZXWCAVOBNDZWNS-UHFFFAOYSA-N
MW242.32 g/mol
LogP2.79
Rot. Bonds2

About bis(2,6-dimethyl-3-pyridinyl)methanol

bis(2,6-dimethyl-3-pyridinyl)methanol (PubChem CID 141423650) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is bis(2,6-dimethyl-3-pyridinyl)methanol.

Molecular Properties

Compound Namebis(2,6-dimethyl-3-pyridinyl)methanol
PubChem CID141423650
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC Namebis(2,6-dimethyl-3-pyridinyl)methanol
SMILESCc1ccc(C(O)c2ccc(C)nc2C)c(C)n1
InChIInChI=1S/C15H18N2O/c1-9-5-7-13(11(3)16-9)15(18)14-8-6-10(2)17-12(14)4/h5-8,15,18H,1-4H3
InChIKeyZXWCAVOBNDZWNS-UHFFFAOYSA-N
XLogP2.79
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2,4-dimethylphenyl)-(2,6-dimethyl-3-pyridinyl)methanol
CID 115604805
(2,6-dimethyl-3-pyridinyl)-phenylmethanol
CID 115604798
(2,6-dimethyl-3-pyridinyl)-(4-propan-2-ylphenyl)methanol
CID 115604819
(2,4-dichlorophenyl)-(2,6-dimethyl-3-pyridinyl)methanol
CID 167910776
1-(2,6-dimethyl-3-pyridinyl)-2-methylpropan-1-ol
CID 105133610
(2,6-dimethyl-3-pyridinyl)-isoquinolin-4-ylmethanol
CID 105097633
(2,6-dimethyl-3-pyridinyl)-thiophen-3-ylmethanol
CID 105102734
(1R,2S)-1-amino-1-(2,6-dimethyl-3-pyridinyl)propan-2-ol
CID 55292437
1-(2,6-dimethyl-3-pyridinyl)-2-ethylbutan-1-ol
CID 105114692
1-(2,6-dimethyl-3-pyridinyl)pentan-1-ol
CID 105085207
(2R)-2-amino-2-(2,6-dimethyl-3-pyridinyl)ethanol
CID 96740448
3,4-dihydro-2H-pyran-5-yl-(2,6-dimethyl-3-pyridinyl)methanol
CID 105124497

Frequently Asked Questions

What is the IUPAC name of bis(2,6-dimethyl-3-pyridinyl)methanol?
The IUPAC name of bis(2,6-dimethyl-3-pyridinyl)methanol (CID 141423650) is bis(2,6-dimethyl-3-pyridinyl)methanol.
What is the SMILES notation for bis(2,6-dimethyl-3-pyridinyl)methanol?
The canonical SMILES for bis(2,6-dimethyl-3-pyridinyl)methanol is Cc1ccc(C(O)c2ccc(C)nc2C)c(C)n1.
What is the InChIKey of bis(2,6-dimethyl-3-pyridinyl)methanol?
The InChIKey is ZXWCAVOBNDZWNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c1-9-5-7-13(11(3)16-9)15(18)14-8-6-10(2)17-12(14)4/h5-8,15,18H,1-4H3.
What are the key properties of bis(2,6-dimethyl-3-pyridinyl)methanol?
bis(2,6-dimethyl-3-pyridinyl)methanol has a molecular weight of 242.32 g/mol, XLogP of 2.79, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for bis(2,6-dimethyl-3-pyridinyl)methanol is sourced from PubChem (CID 141423650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).