4-(propylamino)pyridin-3-ol

C8H12N2O — CID 54404108

IUPAC4-(propylamino)pyridin-3-ol
SMILESCCCNc1ccncc1O
InChIInChI=1S/C8H12N2O/c1-2-4-10-7-3-5-9-6-8(7)11/h3,5-6,11H,2,4H2,1H3,(H,9,10)
InChIKeyVPLLXHNVSNOTJF-UHFFFAOYSA-N
MW152.20 g/mol
LogP1.61
Rot. Bonds3

About 4-(propylamino)pyridin-3-ol

4-(propylamino)pyridin-3-ol (PubChem CID 54404108) has the molecular formula C8H12N2O and a molecular weight of 152.20 g/mol. Its IUPAC name is 4-(propylamino)pyridin-3-ol.

Molecular Properties

Compound Name4-(propylamino)pyridin-3-ol
PubChem CID54404108
Molecular FormulaC8H12N2O
Molecular Weight152.20 g/mol
Exact Mass152.09
IUPAC Name4-(propylamino)pyridin-3-ol
SMILESCCCNc1ccncc1O
InChIInChI=1S/C8H12N2O/c1-2-4-10-7-3-5-9-6-8(7)11/h3,5-6,11H,2,4H2,1H3,(H,9,10)
InChIKeyVPLLXHNVSNOTJF-UHFFFAOYSA-N
XLogP1.61
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.20
LogP ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(propylamino)pyridin-3-ol?
The IUPAC name of 4-(propylamino)pyridin-3-ol (CID 54404108) is 4-(propylamino)pyridin-3-ol.
What is the SMILES notation for 4-(propylamino)pyridin-3-ol?
The canonical SMILES for 4-(propylamino)pyridin-3-ol is CCCNc1ccncc1O.
What is the InChIKey of 4-(propylamino)pyridin-3-ol?
The InChIKey is VPLLXHNVSNOTJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O/c1-2-4-10-7-3-5-9-6-8(7)11/h3,5-6,11H,2,4H2,1H3,(H,9,10).
What are the key properties of 4-(propylamino)pyridin-3-ol?
4-(propylamino)pyridin-3-ol has a molecular weight of 152.20 g/mol, XLogP of 1.61, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(propylamino)pyridin-3-ol is sourced from PubChem (CID 54404108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).