N-hydroxy-7-(3-methoxypropyl)-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide

C13H19N3O3 — CID 169125152

IUPACN-hydroxy-7-(3-methoxypropyl)-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide
SMILESCOCCCN1CCc2cc(C(=O)NO)cnc2C1
InChIInChI=1S/C13H19N3O3/c1-19-6-2-4-16-5-3-10-7-11(13(17)15-18)8-14-12(10)9-16/h7-8,18H,2-6,9H2,1H3,(H,15,17)
InChIKeyXWZSEOXKQBNUKE-UHFFFAOYSA-N
MW265.31 g/mol
LogP0.60
Rot. Bonds5

About N-hydroxy-7-(3-methoxypropyl)-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide

N-hydroxy-7-(3-methoxypropyl)-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide (PubChem CID 169125152) has the molecular formula C13H19N3O3 and a molecular weight of 265.31 g/mol. Its IUPAC name is N-hydroxy-7-(3-methoxypropyl)-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide.

Molecular Properties

Compound NameN-hydroxy-7-(3-methoxypropyl)-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide
PubChem CID169125152
Molecular FormulaC13H19N3O3
Molecular Weight265.31 g/mol
Exact Mass265.14
IUPAC NameN-hydroxy-7-(3-methoxypropyl)-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide
SMILESCOCCCN1CCc2cc(C(=O)NO)cnc2C1
InChIInChI=1S/C13H19N3O3/c1-19-6-2-4-16-5-3-10-7-11(13(17)15-18)8-14-12(10)9-16/h7-8,18H,2-6,9H2,1H3,(H,15,17)
InChIKeyXWZSEOXKQBNUKE-UHFFFAOYSA-N
XLogP0.60
TPSA74.69 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.31
LogP ≤ 50.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-hydroxy-7-(3-methoxypropyl)-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide?
The IUPAC name of N-hydroxy-7-(3-methoxypropyl)-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide (CID 169125152) is N-hydroxy-7-(3-methoxypropyl)-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide.
What is the SMILES notation for N-hydroxy-7-(3-methoxypropyl)-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide?
The canonical SMILES for N-hydroxy-7-(3-methoxypropyl)-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide is COCCCN1CCc2cc(C(=O)NO)cnc2C1.
What is the InChIKey of N-hydroxy-7-(3-methoxypropyl)-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide?
The InChIKey is XWZSEOXKQBNUKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O3/c1-19-6-2-4-16-5-3-10-7-11(13(17)15-18)8-14-12(10)9-16/h7-8,18H,2-6,9H2,1H3,(H,15,17).
What are the key properties of N-hydroxy-7-(3-methoxypropyl)-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide?
N-hydroxy-7-(3-methoxypropyl)-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide has a molecular weight of 265.31 g/mol, XLogP of 0.60, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-7-(3-methoxypropyl)-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide is sourced from PubChem (CID 169125152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).