2-oxo-3,4-dihydro-1H-1,5-naphthyridine-3-carboxamide

C9H9N3O2 — CID 141006823

IUPAC2-oxo-3,4-dihydro-1H-1,5-naphthyridine-3-carboxamide
SMILESNC(=O)C1Cc2ncccc2NC1=O
InChIInChI=1S/C9H9N3O2/c10-8(13)5-4-7-6(12-9(5)14)2-1-3-11-7/h1-3,5H,4H2,(H2,10,13)(H,12,14)
InChIKeyNRJKWAILJNPKNU-UHFFFAOYSA-N
MW191.19 g/mol
LogP-0.32
Rot. Bonds1

About 2-oxo-3,4-dihydro-1H-1,5-naphthyridine-3-carboxamide

2-oxo-3,4-dihydro-1H-1,5-naphthyridine-3-carboxamide (PubChem CID 141006823) has the molecular formula C9H9N3O2 and a molecular weight of 191.19 g/mol. Its IUPAC name is 2-oxo-3,4-dihydro-1H-1,5-naphthyridine-3-carboxamide.

Molecular Properties

Compound Name2-oxo-3,4-dihydro-1H-1,5-naphthyridine-3-carboxamide
PubChem CID141006823
Molecular FormulaC9H9N3O2
Molecular Weight191.19 g/mol
Exact Mass191.07
IUPAC Name2-oxo-3,4-dihydro-1H-1,5-naphthyridine-3-carboxamide
SMILESNC(=O)C1Cc2ncccc2NC1=O
InChIInChI=1S/C9H9N3O2/c10-8(13)5-4-7-6(12-9(5)14)2-1-3-11-7/h1-3,5H,4H2,(H2,10,13)(H,12,14)
InChIKeyNRJKWAILJNPKNU-UHFFFAOYSA-N
XLogP-0.32
TPSA85.08 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.19
LogP ≤ 5-0.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}

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Related Compounds

2,3-dihydro-1H-pyrrolo[3,2-b]pyridine-2-carboxamide
CID 140922627
1,2,3,4-tetrahydro-1,5-naphthyridine-4-carboxamide
CID 70286251
3-hydroxy-1,3-dihydropyrrolo[3,2-b]pyridin-2-one
CID 175730735
1,4-dihydro-1,5-naphthyridine-2,3-dione
CID 58564731
2,3-dichloro-N-[(3R)-2-oxo-3,4-dihydro-1H-1,5-naphthyridin-3-yl]-4H-thieno[3,2-b]pyrrole-5-carboxamide
CID 129384438
1,2,3,4-tetrahydro-1,5-naphthyridine-3-carbaldehyde
CID 158019694
3H-pyrrolo[3,2-b]pyridine;urea
CID 160799180
3-benzoyl-3,4-dihydro-1H-quinolin-2-one
CID 154640290
2,7,12-triazatricyclo[6.4.0.02,5]dodeca-1(8),9,11-trien-6-one
CID 141273952
3-amino-3,4-dihydro-1H-quinolin-2-one;hydroiodide
CID 17234022
6-amino-6,7-dihydrocyclopenta[b]pyridin-5-one
CID 84649209
tert-butyl 5-oxo-6,7-dihydrocyclopenta[b]pyridine-6-carboxylate
CID 134862781

Frequently Asked Questions

What is the IUPAC name of 2-oxo-3,4-dihydro-1H-1,5-naphthyridine-3-carboxamide?
The IUPAC name of 2-oxo-3,4-dihydro-1H-1,5-naphthyridine-3-carboxamide (CID 141006823) is 2-oxo-3,4-dihydro-1H-1,5-naphthyridine-3-carboxamide.
What is the SMILES notation for 2-oxo-3,4-dihydro-1H-1,5-naphthyridine-3-carboxamide?
The canonical SMILES for 2-oxo-3,4-dihydro-1H-1,5-naphthyridine-3-carboxamide is NC(=O)C1Cc2ncccc2NC1=O.
What is the InChIKey of 2-oxo-3,4-dihydro-1H-1,5-naphthyridine-3-carboxamide?
The InChIKey is NRJKWAILJNPKNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3O2/c10-8(13)5-4-7-6(12-9(5)14)2-1-3-11-7/h1-3,5H,4H2,(H2,10,13)(H,12,14).
What are the key properties of 2-oxo-3,4-dihydro-1H-1,5-naphthyridine-3-carboxamide?
2-oxo-3,4-dihydro-1H-1,5-naphthyridine-3-carboxamide has a molecular weight of 191.19 g/mol, XLogP of -0.32, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxo-3,4-dihydro-1H-1,5-naphthyridine-3-carboxamide is sourced from PubChem (CID 141006823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).