N-hydroxy-7-[(3R,4R)-5-methyl-5-azaspiro[3.4]octan-3-yl]-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide

C17H24N4O2 — CID 176769078

IUPACN-hydroxy-7-[(3R,4R)-5-methyl-5-azaspiro[3.4]octan-3-yl]-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide
SMILESCN1CCC[C@]12CC[C@H]2N1CCc2cc(C(=O)NO)cnc2C1
InChIInChI=1S/C17H24N4O2/c1-20-7-2-5-17(20)6-3-15(17)21-8-4-12-9-13(16(22)19-23)10-18-14(12)11-21/h9-10,15,23H,2-8,11H2,1H3,(H,19,22)/t15-,17-/m1/s1
InChIKeyXATNBDXPZBQZHC-NVXWUHKLSA-N
MW316.40 g/mol
LogP1.19
Rot. Bonds2

About N-hydroxy-7-[(3R,4R)-5-methyl-5-azaspiro[3.4]octan-3-yl]-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide

N-hydroxy-7-[(3R,4R)-5-methyl-5-azaspiro[3.4]octan-3-yl]-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide (PubChem CID 176769078) has the molecular formula C17H24N4O2 and a molecular weight of 316.40 g/mol. Its IUPAC name is N-hydroxy-7-[(3R,4R)-5-methyl-5-azaspiro[3.4]octan-3-yl]-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide.

Molecular Properties

Compound NameN-hydroxy-7-[(3R,4R)-5-methyl-5-azaspiro[3.4]octan-3-yl]-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide
PubChem CID176769078
Molecular FormulaC17H24N4O2
Molecular Weight316.40 g/mol
Exact Mass316.19
IUPAC NameN-hydroxy-7-[(3R,4R)-5-methyl-5-azaspiro[3.4]octan-3-yl]-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide
SMILESCN1CCC[C@]12CC[C@H]2N1CCc2cc(C(=O)NO)cnc2C1
InChIInChI=1S/C17H24N4O2/c1-20-7-2-5-17(20)6-3-15(17)21-8-4-12-9-13(16(22)19-23)10-18-14(12)11-21/h9-10,15,23H,2-8,11H2,1H3,(H,19,22)/t15-,17-/m1/s1
InChIKeyXATNBDXPZBQZHC-NVXWUHKLSA-N
XLogP1.19
TPSA68.70 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.40
LogP ≤ 51.19
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-[(3R,4R)-5-acetyl-5-azaspiro[3.5]nonan-3-yl]-N-hydroxy-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide
CID 169125246
N-hydroxy-7-[(3S)-spiro[3.4]octan-3-yl]-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide
CID 176769059
N-hydroxy-7-(2-methyl-2-azaspiro[3.3]heptan-7-yl)-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide
CID 169125550
8-fluoro-N-hydroxy-2-[(3R,4R)-5-methyl-5-azaspiro[3.5]nonan-3-yl]-3,4-dihydro-1H-isoquinoline-6-carboxamide
CID 164868176
N-hydroxy-7-(2-oxaspiro[3.3]heptan-7-yl)-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide
CID 169125387
N-hydroxy-7-[(3R,5S)-7-methyl-7-azaspiro[4.5]decan-3-yl]-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide
CID 169125172
7-[(4aS,6R)-1-methyl-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-6-yl]-N-hydroxy-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide
CID 169125334
7-[5-(difluoromethyl)-5-azaspiro[3.5]nonan-2-yl]-N-hydroxy-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide
CID 169125654
6-cyclobutyl-N-hydroxy-7,8-dihydro-5H-1,6-naphthyridine-3-carboxamide
CID 169125717
N-hydroxy-7-[(1S)-3-[3-(methylamino)propyl]cyclobut-2-en-1-yl]-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide
CID 170133954
7-(cyclobutylmethyl)-N-hydroxy-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide
CID 169125281
7-[3-(3-aminopropyl)cyclobutyl]-N-hydroxy-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide;molecular hydrogen
CID 169125895

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-7-[(3R,4R)-5-methyl-5-azaspiro[3.4]octan-3-yl]-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide?
The IUPAC name of N-hydroxy-7-[(3R,4R)-5-methyl-5-azaspiro[3.4]octan-3-yl]-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide (CID 176769078) is N-hydroxy-7-[(3R,4R)-5-methyl-5-azaspiro[3.4]octan-3-yl]-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide.
What is the SMILES notation for N-hydroxy-7-[(3R,4R)-5-methyl-5-azaspiro[3.4]octan-3-yl]-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide?
The canonical SMILES for N-hydroxy-7-[(3R,4R)-5-methyl-5-azaspiro[3.4]octan-3-yl]-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide is CN1CCC[C@]12CC[C@H]2N1CCc2cc(C(=O)NO)cnc2C1.
What is the InChIKey of N-hydroxy-7-[(3R,4R)-5-methyl-5-azaspiro[3.4]octan-3-yl]-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide?
The InChIKey is XATNBDXPZBQZHC-NVXWUHKLSA-N. The full InChI is InChI=1S/C17H24N4O2/c1-20-7-2-5-17(20)6-3-15(17)21-8-4-12-9-13(16(22)19-23)10-18-14(12)11-21/h9-10,15,23H,2-8,11H2,1H3,(H,19,22)/t15-,17-/m1/s1.
What are the key properties of N-hydroxy-7-[(3R,4R)-5-methyl-5-azaspiro[3.4]octan-3-yl]-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide?
N-hydroxy-7-[(3R,4R)-5-methyl-5-azaspiro[3.4]octan-3-yl]-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide has a molecular weight of 316.40 g/mol, XLogP of 1.19, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-7-[(3R,4R)-5-methyl-5-azaspiro[3.4]octan-3-yl]-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide is sourced from PubChem (CID 176769078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).