3-methyl-2,3-dihydropyridin-2-ol

C6H9NO — CID 91200663

IUPAC3-methyl-2,3-dihydropyridin-2-ol
SMILESCC1C=CC=NC1O
InChIInChI=1S/C6H9NO/c1-5-3-2-4-7-6(5)8/h2-6,8H,1H3
InChIKeyIXOKIANTUISSRN-UHFFFAOYSA-N
MW111.14 g/mol
LogP0.58
Rot. Bonds

About 3-methyl-2,3-dihydropyridin-2-ol

3-methyl-2,3-dihydropyridin-2-ol (PubChem CID 91200663) has the molecular formula C6H9NO and a molecular weight of 111.14 g/mol. Its IUPAC name is 3-methyl-2,3-dihydropyridin-2-ol.

Molecular Properties

Compound Name3-methyl-2,3-dihydropyridin-2-ol
PubChem CID91200663
Molecular FormulaC6H9NO
Molecular Weight111.14 g/mol
Exact Mass111.07
IUPAC Name3-methyl-2,3-dihydropyridin-2-ol
SMILESCC1C=CC=NC1O
InChIInChI=1S/C6H9NO/c1-5-3-2-4-7-6(5)8/h2-6,8H,1H3
InChIKeyIXOKIANTUISSRN-UHFFFAOYSA-N
XLogP0.58
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500111.14
LogP ≤ 50.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-2,3-dihydropyridin-2-ol?
The IUPAC name of 3-methyl-2,3-dihydropyridin-2-ol (CID 91200663) is 3-methyl-2,3-dihydropyridin-2-ol.
What is the SMILES notation for 3-methyl-2,3-dihydropyridin-2-ol?
The canonical SMILES for 3-methyl-2,3-dihydropyridin-2-ol is CC1C=CC=NC1O.
What is the InChIKey of 3-methyl-2,3-dihydropyridin-2-ol?
The InChIKey is IXOKIANTUISSRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9NO/c1-5-3-2-4-7-6(5)8/h2-6,8H,1H3.
What are the key properties of 3-methyl-2,3-dihydropyridin-2-ol?
3-methyl-2,3-dihydropyridin-2-ol has a molecular weight of 111.14 g/mol, XLogP of 0.58, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-2,3-dihydropyridin-2-ol is sourced from PubChem (CID 91200663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).