3-hydroxy-N-(1,2,3,4-tetrahydroquinolin-6-yl)pyridine-4-carboxamide

C15H15N3O2 — CID 81445909

IUPAC3-hydroxy-N-(1,2,3,4-tetrahydroquinolin-6-yl)pyridine-4-carboxamide
SMILESO=C(Nc1ccc2c(c1)CCCN2)c1ccncc1O
InChIInChI=1S/C15H15N3O2/c19-14-9-16-7-5-12(14)15(20)18-11-3-4-13-10(8-11)2-1-6-17-13/h3-5,7-9,17,19H,1-2,6H2,(H,18,20)
InChIKeyQVYBLRQBNKCCFM-UHFFFAOYSA-N
MW269.30 g/mol
LogP2.40
Rot. Bonds2

About 3-hydroxy-N-(1,2,3,4-tetrahydroquinolin-6-yl)pyridine-4-carboxamide

3-hydroxy-N-(1,2,3,4-tetrahydroquinolin-6-yl)pyridine-4-carboxamide (PubChem CID 81445909) has the molecular formula C15H15N3O2 and a molecular weight of 269.30 g/mol. Its IUPAC name is 3-hydroxy-N-(1,2,3,4-tetrahydroquinolin-6-yl)pyridine-4-carboxamide.

Molecular Properties

Compound Name3-hydroxy-N-(1,2,3,4-tetrahydroquinolin-6-yl)pyridine-4-carboxamide
PubChem CID81445909
Molecular FormulaC15H15N3O2
Molecular Weight269.30 g/mol
Exact Mass269.12
IUPAC Name3-hydroxy-N-(1,2,3,4-tetrahydroquinolin-6-yl)pyridine-4-carboxamide
SMILESO=C(Nc1ccc2c(c1)CCCN2)c1ccncc1O
InChIInChI=1S/C15H15N3O2/c19-14-9-16-7-5-12(14)15(20)18-11-3-4-13-10(8-11)2-1-6-17-13/h3-5,7-9,17,19H,1-2,6H2,(H,18,20)
InChIKeyQVYBLRQBNKCCFM-UHFFFAOYSA-N
XLogP2.40
TPSA74.25 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.30
LogP ≤ 52.40
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-N-(1,2,3,4-tetrahydroquinolin-6-yl)pyridine-4-carboxamide?
The IUPAC name of 3-hydroxy-N-(1,2,3,4-tetrahydroquinolin-6-yl)pyridine-4-carboxamide (CID 81445909) is 3-hydroxy-N-(1,2,3,4-tetrahydroquinolin-6-yl)pyridine-4-carboxamide.
What is the SMILES notation for 3-hydroxy-N-(1,2,3,4-tetrahydroquinolin-6-yl)pyridine-4-carboxamide?
The canonical SMILES for 3-hydroxy-N-(1,2,3,4-tetrahydroquinolin-6-yl)pyridine-4-carboxamide is O=C(Nc1ccc2c(c1)CCCN2)c1ccncc1O.
What is the InChIKey of 3-hydroxy-N-(1,2,3,4-tetrahydroquinolin-6-yl)pyridine-4-carboxamide?
The InChIKey is QVYBLRQBNKCCFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O2/c19-14-9-16-7-5-12(14)15(20)18-11-3-4-13-10(8-11)2-1-6-17-13/h3-5,7-9,17,19H,1-2,6H2,(H,18,20).
What are the key properties of 3-hydroxy-N-(1,2,3,4-tetrahydroquinolin-6-yl)pyridine-4-carboxamide?
3-hydroxy-N-(1,2,3,4-tetrahydroquinolin-6-yl)pyridine-4-carboxamide has a molecular weight of 269.30 g/mol, XLogP of 2.40, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-N-(1,2,3,4-tetrahydroquinolin-6-yl)pyridine-4-carboxamide is sourced from PubChem (CID 81445909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).