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

C13H17N3O3 — CID 169125813

IUPACN-hydroxy-7-(oxetan-3-ylmethyl)-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide
SMILESO=C(NO)c1cnc2c(c1)CCN(CC1COC1)C2
InChIInChI=1S/C13H17N3O3/c17-13(15-18)11-3-10-1-2-16(5-9-7-19-8-9)6-12(10)14-4-11/h3-4,9,18H,1-2,5-8H2,(H,15,17)
InChIKeyZZAOCLQDPXIDJA-UHFFFAOYSA-N
MW263.30 g/mol
LogP0.21
Rot. Bonds3

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

N-hydroxy-7-(oxetan-3-ylmethyl)-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide (PubChem CID 169125813) has the molecular formula C13H17N3O3 and a molecular weight of 263.30 g/mol. Its IUPAC name is N-hydroxy-7-(oxetan-3-ylmethyl)-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide.

Molecular Properties

Compound NameN-hydroxy-7-(oxetan-3-ylmethyl)-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide
PubChem CID169125813
Molecular FormulaC13H17N3O3
Molecular Weight263.30 g/mol
Exact Mass263.13
IUPAC NameN-hydroxy-7-(oxetan-3-ylmethyl)-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide
SMILESO=C(NO)c1cnc2c(c1)CCN(CC1COC1)C2
InChIInChI=1S/C13H17N3O3/c17-13(15-18)11-3-10-1-2-16(5-9-7-19-8-9)6-12(10)14-4-11/h3-4,9,18H,1-2,5-8H2,(H,15,17)
InChIKeyZZAOCLQDPXIDJA-UHFFFAOYSA-N
XLogP0.21
TPSA74.69 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.30
LogP ≤ 50.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

7-(cyclobutylmethyl)-N-hydroxy-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide
CID 169125281
N-hydroxy-7-(spiro[4.5]decan-3-ylmethyl)-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide
CID 169125578
7-[(7-cyclopropyl-7-azaspiro[3.5]nonan-2-yl)methyl]-N-hydroxy-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide
CID 169125084
N-hydroxy-7-(3-methoxypropyl)-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide
CID 169125152
6-[[(3R)-2-cyclopropyl-2-azabicyclo[2.2.2]octan-3-yl]methyl]-N-hydroxy-7,8-dihydro-5H-1,6-naphthyridine-3-carboxamide
CID 176769100
N-hydroxy-7-(2-oxaspiro[3.3]heptan-7-yl)-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide
CID 169125387
N-hydroxy-6-(morpholin-2-ylmethyl)-7,8-dihydro-5H-1,6-naphthyridine-3-carboxamide
CID 169125361
N-hydroxy-7-[2-(methylamino)acetyl]-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide
CID 87147895
N-hydroxy-7-[3-(1-methylcyclopentyl)propyl]-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide;molecular hydrogen
CID 169125557
7-[3-(3-aminopropyl)cyclobutyl]-N-hydroxy-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide;molecular hydrogen
CID 169125895
N-hydroxy-7-[(3S)-spiro[3.4]octan-3-yl]-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide
CID 176769059
N-hydroxy-7-[(1S)-3-[3-(methylamino)propyl]cyclobut-2-en-1-yl]-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide
CID 170133954

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-7-(oxetan-3-ylmethyl)-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide?
The IUPAC name of N-hydroxy-7-(oxetan-3-ylmethyl)-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide (CID 169125813) is N-hydroxy-7-(oxetan-3-ylmethyl)-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide.
What is the SMILES notation for N-hydroxy-7-(oxetan-3-ylmethyl)-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide?
The canonical SMILES for N-hydroxy-7-(oxetan-3-ylmethyl)-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide is O=C(NO)c1cnc2c(c1)CCN(CC1COC1)C2.
What is the InChIKey of N-hydroxy-7-(oxetan-3-ylmethyl)-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide?
The InChIKey is ZZAOCLQDPXIDJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O3/c17-13(15-18)11-3-10-1-2-16(5-9-7-19-8-9)6-12(10)14-4-11/h3-4,9,18H,1-2,5-8H2,(H,15,17).
What are the key properties of N-hydroxy-7-(oxetan-3-ylmethyl)-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide?
N-hydroxy-7-(oxetan-3-ylmethyl)-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide has a molecular weight of 263.30 g/mol, XLogP of 0.21, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-7-(oxetan-3-ylmethyl)-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide is sourced from PubChem (CID 169125813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).