N-(3-morpholin-4-ylpropyl)-6-oxo-1H-pyridine-2-carboxamide

C13H19N3O3 — CID 107261436

IUPACN-(3-morpholin-4-ylpropyl)-6-oxo-1H-pyridine-2-carboxamide
SMILESO=C(NCCCN1CCOCC1)c1cccc(=O)[nH]1
InChIInChI=1S/C13H19N3O3/c17-12-4-1-3-11(15-12)13(18)14-5-2-6-16-7-9-19-10-8-16/h1,3-4H,2,5-10H2,(H,14,18)(H,15,17)
InChIKeyFYJDMZZEHNFFBB-UHFFFAOYSA-N
MW265.31 g/mol
LogP-0.17
Rot. Bonds5

About N-(3-morpholin-4-ylpropyl)-6-oxo-1H-pyridine-2-carboxamide

N-(3-morpholin-4-ylpropyl)-6-oxo-1H-pyridine-2-carboxamide (PubChem CID 107261436) has the molecular formula C13H19N3O3 and a molecular weight of 265.31 g/mol. Its IUPAC name is N-(3-morpholin-4-ylpropyl)-6-oxo-1H-pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(3-morpholin-4-ylpropyl)-6-oxo-1H-pyridine-2-carboxamide
PubChem CID107261436
Molecular FormulaC13H19N3O3
Molecular Weight265.31 g/mol
Exact Mass265.14
IUPAC NameN-(3-morpholin-4-ylpropyl)-6-oxo-1H-pyridine-2-carboxamide
SMILESO=C(NCCCN1CCOCC1)c1cccc(=O)[nH]1
InChIInChI=1S/C13H19N3O3/c17-12-4-1-3-11(15-12)13(18)14-5-2-6-16-7-9-19-10-8-16/h1,3-4H,2,5-10H2,(H,14,18)(H,15,17)
InChIKeyFYJDMZZEHNFFBB-UHFFFAOYSA-N
XLogP-0.17
TPSA74.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.31
LogP ≤ 5-0.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[3-(4-methylpiperidin-1-yl)propyl]-6-oxo-1H-pyridine-2-carboxamide
CID 107261496
1-N,4-N-bis(3-morpholin-4-ylpropyl)benzene-1,4-dicarboxamide;hydrochloride
CID 54609927
3-hydroxy-N-(3-morpholin-4-ylpropyl)benzamide
CID 43236314
2-methyl-N-(3-morpholin-4-ylpropyl)-1H-imidazole-5-carboxamide
CID 110467560
(Z)-but-2-enedioic acid;N-(3-morpholin-4-ylpropyl)-4-oxo-1H-quinoline-2-carboxamide
CID 51057245
3-bromo-2-fluoro-N-(3-morpholin-4-ylpropyl)benzamide
CID 106547752
N-(3-morpholin-4-ylpropyl)-9-oxofluorene-4-carboxamide
CID 2818270
4-bromo-N-(3-morpholin-4-ylpropyl)benzamide
CID 2298646
N-(3-morpholin-4-ylpropyl)-2-propan-2-ylbenzamide
CID 143519809
methyl 3-(3-morpholin-4-ylpropylcarbamoyl)benzoate
CID 108786662
6-morpholin-4-yl-N-(3-morpholin-4-ylpropyl)pyridine-2-carboxamide
CID 84573956
N-(3-morpholin-4-ylpropyl)-6-oxo-5H-phenanthridine-3-carboxamide
CID 67424998

Frequently Asked Questions

What is the IUPAC name of N-(3-morpholin-4-ylpropyl)-6-oxo-1H-pyridine-2-carboxamide?
The IUPAC name of N-(3-morpholin-4-ylpropyl)-6-oxo-1H-pyridine-2-carboxamide (CID 107261436) is N-(3-morpholin-4-ylpropyl)-6-oxo-1H-pyridine-2-carboxamide.
What is the SMILES notation for N-(3-morpholin-4-ylpropyl)-6-oxo-1H-pyridine-2-carboxamide?
The canonical SMILES for N-(3-morpholin-4-ylpropyl)-6-oxo-1H-pyridine-2-carboxamide is O=C(NCCCN1CCOCC1)c1cccc(=O)[nH]1.
What is the InChIKey of N-(3-morpholin-4-ylpropyl)-6-oxo-1H-pyridine-2-carboxamide?
The InChIKey is FYJDMZZEHNFFBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O3/c17-12-4-1-3-11(15-12)13(18)14-5-2-6-16-7-9-19-10-8-16/h1,3-4H,2,5-10H2,(H,14,18)(H,15,17).
What are the key properties of N-(3-morpholin-4-ylpropyl)-6-oxo-1H-pyridine-2-carboxamide?
N-(3-morpholin-4-ylpropyl)-6-oxo-1H-pyridine-2-carboxamide has a molecular weight of 265.31 g/mol, XLogP of -0.17, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-morpholin-4-ylpropyl)-6-oxo-1H-pyridine-2-carboxamide is sourced from PubChem (CID 107261436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).