1-hydroxy-3,4-dihydro-2H-pyridine

C5H9NO — CID 18950550

IUPAC1-hydroxy-3,4-dihydro-2H-pyridine
SMILESON1C=CCCC1
InChIInChI=1S/C5H9NO/c7-6-4-2-1-3-5-6/h2,4,7H,1,3,5H2
InChIKeyCOWSNABOAJJRBM-UHFFFAOYSA-N
MW99.13 g/mol
LogP0.99
Rot. Bonds

About 1-hydroxy-3,4-dihydro-2H-pyridine

1-hydroxy-3,4-dihydro-2H-pyridine (PubChem CID 18950550) has the molecular formula C5H9NO and a molecular weight of 99.13 g/mol. Its IUPAC name is 1-hydroxy-3,4-dihydro-2H-pyridine.

Molecular Properties

Compound Name1-hydroxy-3,4-dihydro-2H-pyridine
PubChem CID18950550
Molecular FormulaC5H9NO
Molecular Weight99.13 g/mol
Exact Mass99.07
IUPAC Name1-hydroxy-3,4-dihydro-2H-pyridine
SMILESON1C=CCCC1
InChIInChI=1S/C5H9NO/c7-6-4-2-1-3-5-6/h2,4,7H,1,3,5H2
InChIKeyCOWSNABOAJJRBM-UHFFFAOYSA-N
XLogP0.99
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50099.13
LogP ≤ 50.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-hydroxy-3,4-dihydro-2H-pyridine 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-hydroxy-3,4-dihydro-2H-pyridine?
The IUPAC name of 1-hydroxy-3,4-dihydro-2H-pyridine (CID 18950550) is 1-hydroxy-3,4-dihydro-2H-pyridine.
What is the SMILES notation for 1-hydroxy-3,4-dihydro-2H-pyridine?
The canonical SMILES for 1-hydroxy-3,4-dihydro-2H-pyridine is ON1C=CCCC1.
What is the InChIKey of 1-hydroxy-3,4-dihydro-2H-pyridine?
The InChIKey is COWSNABOAJJRBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9NO/c7-6-4-2-1-3-5-6/h2,4,7H,1,3,5H2.
What are the key properties of 1-hydroxy-3,4-dihydro-2H-pyridine?
1-hydroxy-3,4-dihydro-2H-pyridine has a molecular weight of 99.13 g/mol, XLogP of 0.99, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxy-3,4-dihydro-2H-pyridine is sourced from PubChem (CID 18950550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).