1-methyl-3,4-dihydro-2H-pyridin-3-ol

C6H11NO — CID 130271776

IUPAC1-methyl-3,4-dihydro-2H-pyridin-3-ol
SMILESCN1C=CCC(O)C1
InChIInChI=1S/C6H11NO/c1-7-4-2-3-6(8)5-7/h2,4,6,8H,3,5H2,1H3
InChIKeyMJDQIKRZGUYNES-UHFFFAOYSA-N
MW113.16 g/mol
LogP0.20
Rot. Bonds

About 1-methyl-3,4-dihydro-2H-pyridin-3-ol

1-methyl-3,4-dihydro-2H-pyridin-3-ol (PubChem CID 130271776) has the molecular formula C6H11NO and a molecular weight of 113.16 g/mol. Its IUPAC name is 1-methyl-3,4-dihydro-2H-pyridin-3-ol.

Molecular Properties

Compound Name1-methyl-3,4-dihydro-2H-pyridin-3-ol
PubChem CID130271776
Molecular FormulaC6H11NO
Molecular Weight113.16 g/mol
Exact Mass113.08
IUPAC Name1-methyl-3,4-dihydro-2H-pyridin-3-ol
SMILESCN1C=CCC(O)C1
InChIInChI=1S/C6H11NO/c1-7-4-2-3-6(8)5-7/h2,4,6,8H,3,5H2,1H3
InChIKeyMJDQIKRZGUYNES-UHFFFAOYSA-N
XLogP0.20
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500113.16
LogP ≤ 50.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-methyl-3,4-dihydro-2H-pyridin-3-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-methyl-3,4-dihydro-2H-pyridin-3-ol?
The IUPAC name of 1-methyl-3,4-dihydro-2H-pyridin-3-ol (CID 130271776) is 1-methyl-3,4-dihydro-2H-pyridin-3-ol.
What is the SMILES notation for 1-methyl-3,4-dihydro-2H-pyridin-3-ol?
The canonical SMILES for 1-methyl-3,4-dihydro-2H-pyridin-3-ol is CN1C=CCC(O)C1.
What is the InChIKey of 1-methyl-3,4-dihydro-2H-pyridin-3-ol?
The InChIKey is MJDQIKRZGUYNES-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO/c1-7-4-2-3-6(8)5-7/h2,4,6,8H,3,5H2,1H3.
What are the key properties of 1-methyl-3,4-dihydro-2H-pyridin-3-ol?
1-methyl-3,4-dihydro-2H-pyridin-3-ol has a molecular weight of 113.16 g/mol, XLogP of 0.20, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3,4-dihydro-2H-pyridin-3-ol is sourced from PubChem (CID 130271776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).