(2,6-dimethyl-4-pyridinyl)methanol

C8H11NO — CID 3825077

IUPAC(2,6-dimethyl-4-pyridinyl)methanol
SMILESCc1cc(CO)cc(C)n1
InChIInChI=1S/C8H11NO/c1-6-3-8(5-10)4-7(2)9-6/h3-4,10H,5H2,1-2H3
InChIKeyDLDGHMPQNVTNRC-UHFFFAOYSA-N
MW137.18 g/mol
LogP1.19
Rot. Bonds1

About (2,6-dimethyl-4-pyridinyl)methanol

(2,6-dimethyl-4-pyridinyl)methanol (PubChem CID 3825077) has the molecular formula C8H11NO and a molecular weight of 137.18 g/mol. Its IUPAC name is (2,6-dimethyl-4-pyridinyl)methanol.

Molecular Properties

Compound Name(2,6-dimethyl-4-pyridinyl)methanol
PubChem CID3825077
Molecular FormulaC8H11NO
Molecular Weight137.18 g/mol
Exact Mass137.08
IUPAC Name(2,6-dimethyl-4-pyridinyl)methanol
SMILESCc1cc(CO)cc(C)n1
InChIInChI=1S/C8H11NO/c1-6-3-8(5-10)4-7(2)9-6/h3-4,10H,5H2,1-2H3
InChIKeyDLDGHMPQNVTNRC-UHFFFAOYSA-N
XLogP1.19
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.18
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2,6-dimethyl-4-pyridinyl)methanol?
The IUPAC name of (2,6-dimethyl-4-pyridinyl)methanol (CID 3825077) is (2,6-dimethyl-4-pyridinyl)methanol.
What is the SMILES notation for (2,6-dimethyl-4-pyridinyl)methanol?
The canonical SMILES for (2,6-dimethyl-4-pyridinyl)methanol is Cc1cc(CO)cc(C)n1.
What is the InChIKey of (2,6-dimethyl-4-pyridinyl)methanol?
The InChIKey is DLDGHMPQNVTNRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NO/c1-6-3-8(5-10)4-7(2)9-6/h3-4,10H,5H2,1-2H3.
What are the key properties of (2,6-dimethyl-4-pyridinyl)methanol?
(2,6-dimethyl-4-pyridinyl)methanol has a molecular weight of 137.18 g/mol, XLogP of 1.19, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2,6-dimethyl-4-pyridinyl)methanol is sourced from PubChem (CID 3825077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).