5-propyl-1,2-dihydropyridin-2-ol

C8H13NO — CID 148992183

IUPAC5-propyl-1,2-dihydropyridin-2-ol
SMILESCCCC1=CNC(O)C=C1
InChIInChI=1S/C8H13NO/c1-2-3-7-4-5-8(10)9-6-7/h4-6,8-10H,2-3H2,1H3
InChIKeyPXXNTPMZWDUOOI-UHFFFAOYSA-N
MW139.20 g/mol
LogP1.15
Rot. Bonds2

About 5-propyl-1,2-dihydropyridin-2-ol

5-propyl-1,2-dihydropyridin-2-ol (PubChem CID 148992183) has the molecular formula C8H13NO and a molecular weight of 139.20 g/mol. Its IUPAC name is 5-propyl-1,2-dihydropyridin-2-ol.

Molecular Properties

Compound Name5-propyl-1,2-dihydropyridin-2-ol
PubChem CID148992183
Molecular FormulaC8H13NO
Molecular Weight139.20 g/mol
Exact Mass139.10
IUPAC Name5-propyl-1,2-dihydropyridin-2-ol
SMILESCCCC1=CNC(O)C=C1
InChIInChI=1S/C8H13NO/c1-2-3-7-4-5-8(10)9-6-7/h4-6,8-10H,2-3H2,1H3
InChIKeyPXXNTPMZWDUOOI-UHFFFAOYSA-N
XLogP1.15
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.20
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-propyl-1,2-dihydropyridin-2-ol?
The IUPAC name of 5-propyl-1,2-dihydropyridin-2-ol (CID 148992183) is 5-propyl-1,2-dihydropyridin-2-ol.
What is the SMILES notation for 5-propyl-1,2-dihydropyridin-2-ol?
The canonical SMILES for 5-propyl-1,2-dihydropyridin-2-ol is CCCC1=CNC(O)C=C1.
What is the InChIKey of 5-propyl-1,2-dihydropyridin-2-ol?
The InChIKey is PXXNTPMZWDUOOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13NO/c1-2-3-7-4-5-8(10)9-6-7/h4-6,8-10H,2-3H2,1H3.
What are the key properties of 5-propyl-1,2-dihydropyridin-2-ol?
5-propyl-1,2-dihydropyridin-2-ol has a molecular weight of 139.20 g/mol, XLogP of 1.15, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-propyl-1,2-dihydropyridin-2-ol is sourced from PubChem (CID 148992183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).