1,4-dihydropyridin-4-ol

C5H7NO — CID 59994773

IUPAC1,4-dihydropyridin-4-ol
SMILESOC1C=CNC=C1
InChIInChI=1S/C5H7NO/c7-5-1-3-6-4-2-5/h1-7H
InChIKeySHOCHHQKIZMABF-UHFFFAOYSA-N
MW97.12 g/mol
LogP-0.02
Rot. Bonds

About 1,4-dihydropyridin-4-ol

1,4-dihydropyridin-4-ol (PubChem CID 59994773) has the molecular formula C5H7NO and a molecular weight of 97.12 g/mol. Its IUPAC name is 1,4-dihydropyridin-4-ol.

Molecular Properties

Compound Name1,4-dihydropyridin-4-ol
PubChem CID59994773
Molecular FormulaC5H7NO
Molecular Weight97.12 g/mol
Exact Mass97.05
IUPAC Name1,4-dihydropyridin-4-ol
SMILESOC1C=CNC=C1
InChIInChI=1S/C5H7NO/c7-5-1-3-6-4-2-5/h1-7H
InChIKeySHOCHHQKIZMABF-UHFFFAOYSA-N
XLogP-0.02
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50097.12
LogP ≤ 5-0.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-Hydroxy-2,3-dihydro-1h-pyrrole
CID 18185791
1,2,3,4-Tetrahydropyridin-4-ol
CID 18950548
2,3-Dichloro-1,4-dihydropyridin-4-ol
CID 58535096
(1Z)-1-(methylamino)penta-1,4-dien-3-ol
CID 89324995
4-Aminobut-3-en-2-ol
CID 140345225
(3S)-2,3-dihydro-1H-pyrrol-3-ol
CID 142652205
(1Z)-1-aminopenta-1,4-dien-3-ol;ethane
CID 143243898
(Z)-4-(methylamino)but-3-en-2-ol
CID 143395047
(E,2S)-4-aminobut-3-en-2-ol
CID 144974174
3-Chloro-1,4-dihydropyridin-4-ol
CID 146499071
3-Methyl-1,4-dihydropyridin-4-ol
CID 148633520
1,2,2,3,3-pentadeuterio-4H-pyridin-4-ol
CID 153710780

Frequently Asked Questions

What is the IUPAC name of 1,4-dihydropyridin-4-ol?
The IUPAC name of 1,4-dihydropyridin-4-ol (CID 59994773) is 1,4-dihydropyridin-4-ol.
What is the SMILES notation for 1,4-dihydropyridin-4-ol?
The canonical SMILES for 1,4-dihydropyridin-4-ol is OC1C=CNC=C1.
What is the InChIKey of 1,4-dihydropyridin-4-ol?
The InChIKey is SHOCHHQKIZMABF-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7NO/c7-5-1-3-6-4-2-5/h1-7H.
What are the key properties of 1,4-dihydropyridin-4-ol?
1,4-dihydropyridin-4-ol has a molecular weight of 97.12 g/mol, XLogP of -0.02, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-dihydropyridin-4-ol is sourced from PubChem (CID 59994773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).