7-[1-(3,7-dimethyl-3-bicyclo[3.3.1]nonanyl)cyclobutyl]-N-hydroxy-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide

C24H35N3O2 — CID 169125933

IUPAC7-[1-(3,7-dimethyl-3-bicyclo[3.3.1]nonanyl)cyclobutyl]-N-hydroxy-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide
SMILESCC1CC2CC(C1)CC(C)(C1(N3CCc4cc(C(=O)NO)cnc4C3)CCC1)C2
InChIInChI=1S/C24H35N3O2/c1-16-8-17-10-18(9-16)13-23(2,12-17)24(5-3-6-24)27-7-4-19-11-20(22(28)26-29)14-25-21(19)15-27/h11,14,16-18,29H,3-10,12-13,15H2,1-2H3,(H,26,28)
InChIKeyXGHAIPPLOXJQOS-UHFFFAOYSA-N
MW397.56 g/mol
LogP4.33
Rot. Bonds3

About 7-[1-(3,7-dimethyl-3-bicyclo[3.3.1]nonanyl)cyclobutyl]-N-hydroxy-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide

7-[1-(3,7-dimethyl-3-bicyclo[3.3.1]nonanyl)cyclobutyl]-N-hydroxy-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide (PubChem CID 169125933) has the molecular formula C24H35N3O2 and a molecular weight of 397.56 g/mol. Its IUPAC name is 7-[1-(3,7-dimethyl-3-bicyclo[3.3.1]nonanyl)cyclobutyl]-N-hydroxy-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide.

Molecular Properties

Compound Name7-[1-(3,7-dimethyl-3-bicyclo[3.3.1]nonanyl)cyclobutyl]-N-hydroxy-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide
PubChem CID169125933
Molecular FormulaC24H35N3O2
Molecular Weight397.56 g/mol
Exact Mass397.27
IUPAC Name7-[1-(3,7-dimethyl-3-bicyclo[3.3.1]nonanyl)cyclobutyl]-N-hydroxy-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide
SMILESCC1CC2CC(C1)CC(C)(C1(N3CCc4cc(C(=O)NO)cnc4C3)CCC1)C2
InChIInChI=1S/C24H35N3O2/c1-16-8-17-10-18(9-16)13-23(2,12-17)24(5-3-6-24)27-7-4-19-11-20(22(28)26-29)14-25-21(19)15-27/h11,14,16-18,29H,3-10,12-13,15H2,1-2H3,(H,26,28)
InChIKeyXGHAIPPLOXJQOS-UHFFFAOYSA-N
XLogP4.33
TPSA65.46 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500397.56
LogP ≤ 54.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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-[(1S)-1-(1-adamantyl)propyl]-N-hydroxy-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide
CID 170133759
N-hydroxy-7-[3-(1-methylcyclopentyl)propyl]-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide;molecular hydrogen
CID 169125557
N-hydroxy-7-[(3S)-spiro[3.4]octan-3-yl]-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide
CID 176769059
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
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
7-(cyclobutylmethyl)-N-hydroxy-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide
CID 169125281
N-hydroxy-7-(2-methyl-2-azaspiro[3.3]heptan-7-yl)-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide
CID 169125550
N-hydroxy-7-(spiro[4.5]decan-3-ylmethyl)-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide
CID 169125578
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-(2-oxaspiro[3.3]heptan-7-yl)-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide
CID 169125387
7-[5-(difluoromethyl)-5-azaspiro[3.5]nonan-2-yl]-N-hydroxy-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide
CID 169125654
N-hydroxy-7-[2-(methylamino)acetyl]-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide
CID 87147895

Frequently Asked Questions

What is the IUPAC name of 7-[1-(3,7-dimethyl-3-bicyclo[3.3.1]nonanyl)cyclobutyl]-N-hydroxy-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide?
The IUPAC name of 7-[1-(3,7-dimethyl-3-bicyclo[3.3.1]nonanyl)cyclobutyl]-N-hydroxy-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide (CID 169125933) is 7-[1-(3,7-dimethyl-3-bicyclo[3.3.1]nonanyl)cyclobutyl]-N-hydroxy-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide.
What is the SMILES notation for 7-[1-(3,7-dimethyl-3-bicyclo[3.3.1]nonanyl)cyclobutyl]-N-hydroxy-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide?
The canonical SMILES for 7-[1-(3,7-dimethyl-3-bicyclo[3.3.1]nonanyl)cyclobutyl]-N-hydroxy-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide is CC1CC2CC(C1)CC(C)(C1(N3CCc4cc(C(=O)NO)cnc4C3)CCC1)C2.
What is the InChIKey of 7-[1-(3,7-dimethyl-3-bicyclo[3.3.1]nonanyl)cyclobutyl]-N-hydroxy-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide?
The InChIKey is XGHAIPPLOXJQOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H35N3O2/c1-16-8-17-10-18(9-16)13-23(2,12-17)24(5-3-6-24)27-7-4-19-11-20(22(28)26-29)14-25-21(19)15-27/h11,14,16-18,29H,3-10,12-13,15H2,1-2H3,(H,26,28).
What are the key properties of 7-[1-(3,7-dimethyl-3-bicyclo[3.3.1]nonanyl)cyclobutyl]-N-hydroxy-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide?
7-[1-(3,7-dimethyl-3-bicyclo[3.3.1]nonanyl)cyclobutyl]-N-hydroxy-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide has a molecular weight of 397.56 g/mol, XLogP of 4.33, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[1-(3,7-dimethyl-3-bicyclo[3.3.1]nonanyl)cyclobutyl]-N-hydroxy-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide is sourced from PubChem (CID 169125933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).