2,4-dimethyl-1H-pyridin-2-ol

C7H11NO — CID 89313275

IUPAC2,4-dimethyl-1H-pyridin-2-ol
SMILESCC1=CC(C)(O)NC=C1
InChIInChI=1S/C7H11NO/c1-6-3-4-8-7(2,9)5-6/h3-5,8-9H,1-2H3
InChIKeyKPJDAOOTMXUQEP-UHFFFAOYSA-N
MW125.17 g/mol
LogP0.76
Rot. Bonds

About 2,4-dimethyl-1H-pyridin-2-ol

2,4-dimethyl-1H-pyridin-2-ol (PubChem CID 89313275) has the molecular formula C7H11NO and a molecular weight of 125.17 g/mol. Its IUPAC name is 2,4-dimethyl-1H-pyridin-2-ol.

Molecular Properties

Compound Name2,4-dimethyl-1H-pyridin-2-ol
PubChem CID89313275
Molecular FormulaC7H11NO
Molecular Weight125.17 g/mol
Exact Mass125.08
IUPAC Name2,4-dimethyl-1H-pyridin-2-ol
SMILESCC1=CC(C)(O)NC=C1
InChIInChI=1S/C7H11NO/c1-6-3-4-8-7(2,9)5-6/h3-5,8-9H,1-2H3
InChIKeyKPJDAOOTMXUQEP-UHFFFAOYSA-N
XLogP0.76
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.17
LogP ≤ 50.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-1H-pyridin-2-ol?
The IUPAC name of 2,4-dimethyl-1H-pyridin-2-ol (CID 89313275) is 2,4-dimethyl-1H-pyridin-2-ol.
What is the SMILES notation for 2,4-dimethyl-1H-pyridin-2-ol?
The canonical SMILES for 2,4-dimethyl-1H-pyridin-2-ol is CC1=CC(C)(O)NC=C1.
What is the InChIKey of 2,4-dimethyl-1H-pyridin-2-ol?
The InChIKey is KPJDAOOTMXUQEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11NO/c1-6-3-4-8-7(2,9)5-6/h3-5,8-9H,1-2H3.
What are the key properties of 2,4-dimethyl-1H-pyridin-2-ol?
2,4-dimethyl-1H-pyridin-2-ol has a molecular weight of 125.17 g/mol, XLogP of 0.76, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-1H-pyridin-2-ol is sourced from PubChem (CID 89313275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).