(3,5-dimethyl-2-pyridinyl)methanol

C8H11NO — CID 10630548

IUPAC(3,5-dimethyl-2-pyridinyl)methanol
SMILESCc1cnc(CO)c(C)c1
InChIInChI=1S/C8H11NO/c1-6-3-7(2)8(5-10)9-4-6/h3-4,10H,5H2,1-2H3
InChIKeyBBUQQGMZGGFKDP-UHFFFAOYSA-N
MW137.18 g/mol
LogP1.19
Rot. Bonds1

About (3,5-dimethyl-2-pyridinyl)methanol

(3,5-dimethyl-2-pyridinyl)methanol (PubChem CID 10630548) has the molecular formula C8H11NO and a molecular weight of 137.18 g/mol. Its IUPAC name is (3,5-dimethyl-2-pyridinyl)methanol.

Molecular Properties

Compound Name(3,5-dimethyl-2-pyridinyl)methanol
PubChem CID10630548
Molecular FormulaC8H11NO
Molecular Weight137.18 g/mol
Exact Mass137.08
IUPAC Name(3,5-dimethyl-2-pyridinyl)methanol
SMILESCc1cnc(CO)c(C)c1
InChIInChI=1S/C8H11NO/c1-6-3-7(2)8(5-10)9-4-6/h3-4,10H,5H2,1-2H3
InChIKeyBBUQQGMZGGFKDP-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 (3,5-dimethyl-2-pyridinyl)methanol?
The IUPAC name of (3,5-dimethyl-2-pyridinyl)methanol (CID 10630548) is (3,5-dimethyl-2-pyridinyl)methanol.
What is the SMILES notation for (3,5-dimethyl-2-pyridinyl)methanol?
The canonical SMILES for (3,5-dimethyl-2-pyridinyl)methanol is Cc1cnc(CO)c(C)c1.
What is the InChIKey of (3,5-dimethyl-2-pyridinyl)methanol?
The InChIKey is BBUQQGMZGGFKDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NO/c1-6-3-7(2)8(5-10)9-4-6/h3-4,10H,5H2,1-2H3.
What are the key properties of (3,5-dimethyl-2-pyridinyl)methanol?
(3,5-dimethyl-2-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 (3,5-dimethyl-2-pyridinyl)methanol is sourced from PubChem (CID 10630548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).