5-hydroxy-N-[4-(propanoylamino)phenyl]pyridine-3-carboxamide

C15H15N3O3 — CID 63859925

IUPAC5-hydroxy-N-[4-(propanoylamino)phenyl]pyridine-3-carboxamide
SMILESCCC(=O)Nc1ccc(NC(=O)c2cncc(O)c2)cc1
InChIInChI=1S/C15H15N3O3/c1-2-14(20)17-11-3-5-12(6-4-11)18-15(21)10-7-13(19)9-16-8-10/h3-9,19H,2H2,1H3,(H,17,20)(H,18,21)
InChIKeyCZTBSJZTUNSORE-UHFFFAOYSA-N
MW285.30 g/mol
LogP2.39
Rot. Bonds4

About 5-hydroxy-N-[4-(propanoylamino)phenyl]pyridine-3-carboxamide

5-hydroxy-N-[4-(propanoylamino)phenyl]pyridine-3-carboxamide (PubChem CID 63859925) has the molecular formula C15H15N3O3 and a molecular weight of 285.30 g/mol. Its IUPAC name is 5-hydroxy-N-[4-(propanoylamino)phenyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name5-hydroxy-N-[4-(propanoylamino)phenyl]pyridine-3-carboxamide
PubChem CID63859925
Molecular FormulaC15H15N3O3
Molecular Weight285.30 g/mol
Exact Mass285.11
IUPAC Name5-hydroxy-N-[4-(propanoylamino)phenyl]pyridine-3-carboxamide
SMILESCCC(=O)Nc1ccc(NC(=O)c2cncc(O)c2)cc1
InChIInChI=1S/C15H15N3O3/c1-2-14(20)17-11-3-5-12(6-4-11)18-15(21)10-7-13(19)9-16-8-10/h3-9,19H,2H2,1H3,(H,17,20)(H,18,21)
InChIKeyCZTBSJZTUNSORE-UHFFFAOYSA-N
XLogP2.39
TPSA91.32 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.30
LogP ≤ 52.39
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-hydroxy-N-[4-(propanoylamino)phenyl]pyridine-3-carboxamide?
The IUPAC name of 5-hydroxy-N-[4-(propanoylamino)phenyl]pyridine-3-carboxamide (CID 63859925) is 5-hydroxy-N-[4-(propanoylamino)phenyl]pyridine-3-carboxamide.
What is the SMILES notation for 5-hydroxy-N-[4-(propanoylamino)phenyl]pyridine-3-carboxamide?
The canonical SMILES for 5-hydroxy-N-[4-(propanoylamino)phenyl]pyridine-3-carboxamide is CCC(=O)Nc1ccc(NC(=O)c2cncc(O)c2)cc1.
What is the InChIKey of 5-hydroxy-N-[4-(propanoylamino)phenyl]pyridine-3-carboxamide?
The InChIKey is CZTBSJZTUNSORE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O3/c1-2-14(20)17-11-3-5-12(6-4-11)18-15(21)10-7-13(19)9-16-8-10/h3-9,19H,2H2,1H3,(H,17,20)(H,18,21).
What are the key properties of 5-hydroxy-N-[4-(propanoylamino)phenyl]pyridine-3-carboxamide?
5-hydroxy-N-[4-(propanoylamino)phenyl]pyridine-3-carboxamide has a molecular weight of 285.30 g/mol, XLogP of 2.39, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-N-[4-(propanoylamino)phenyl]pyridine-3-carboxamide is sourced from PubChem (CID 63859925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).