3-methylidene-7-(4-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-2,7-diazaspiro[4.4]nonan-1-one;3-methylidene-7-(5-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-2,7-diazaspiro[4.4]nonan-1-one;2-methylidene-7-(2-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one;2-methylidene-7-(5-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one;2-methylidene-7-(6-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one;2-methylidene-7-(7-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one

C92H92N28O12 — CID 158773332

IUPAC3-methylidene-7-(4-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-2,7-diazaspiro[4.4]nonan-1-one;3-methylidene-7-(5-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-2,7-diazaspiro[4.4]nonan-1-one;2-methylidene-7-(2-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one;2-methylidene-7-(5-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one;2-methylidene-7-(6-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one;2-methylidene-7-(7-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one
SMILES[3H]c1ccc2c(C(=O)N3CCC4(C3)NC(=C)NC4=O)cnn2c1.[3H]c1cccc2c(C(=O)N3CCC4(C3)NC(=C)NC4=O)cnn12.[3H]c1cccn2ncc(C(=O)N3CCC4(CC(=C)NC4=O)C3)c12.[3H]c1ccn2ncc(C(=O)N3CCC4(C3)NC(=C)NC4=O)c2c1.[3H]c1ccn2ncc(C(=O)N3CCC4(CC(=C)NC4=O)C3)c2c1.[3H]c1nn2ccccc2c1C(=O)N1CCC2(C1)NC(=C)NC2=O
InChIInChI=1S/2C16H16N4O2.4C15H15N5O2/c2*1-11-8-16(15(22)18-11)5-7-19(10-16)14(21)12-9-17-20-6-3-2-4-13(12)20;4*1-10-17-14(22)15(18-10)5-7-19(9-15)13(21)11-8-16-20-6-3-2-4-12(11)20/h2*2-4,6,9H,1,5,7-8,10H2,(H,18,22);4*2-4,6,8,18H,1,5,7,9H2,(H,17,22)/i4T;2T;8T;6T;3T;2T
InChIKeyIQDQCUHSSMKNKU-NWJDHSCMSA-N
MW1793.98 g/mol
LogP2.84
Rot. Bonds6

About 3-methylidene-7-(4-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-2,7-diazaspiro[4.4]nonan-1-one;3-methylidene-7-(5-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-2,7-diazaspiro[4.4]nonan-1-one;2-methylidene-7-(2-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one;2-methylidene-7-(5-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one;2-methylidene-7-(6-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one;2-methylidene-7-(7-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one

3-methylidene-7-(4-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-2,7-diazaspiro[4.4]nonan-1-one;3-methylidene-7-(5-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-2,7-diazaspiro[4.4]nonan-1-one;2-methylidene-7-(2-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one;2-methylidene-7-(5-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one;2-methylidene-7-(6-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one;2-methylidene-7-(7-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one (PubChem CID 158773332) has the molecular formula C92H92N28O12 and a molecular weight of 1793.98 g/mol. Its IUPAC name is 3-methylidene-7-(4-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-2,7-diazaspiro[4.4]nonan-1-one;3-methylidene-7-(5-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-2,7-diazaspiro[4.4]nonan-1-one;2-methylidene-7-(2-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one;2-methylidene-7-(5-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one;2-methylidene-7-(6-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one;2-methylidene-7-(7-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one.

Molecular Properties

Compound Name3-methylidene-7-(4-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-2,7-diazaspiro[4.4]nonan-1-one;3-methylidene-7-(5-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-2,7-diazaspiro[4.4]nonan-1-one;2-methylidene-7-(2-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one;2-methylidene-7-(5-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one;2-methylidene-7-(6-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one;2-methylidene-7-(7-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one
PubChem CID158773332
Molecular FormulaC92H92N28O12
Molecular Weight1793.98 g/mol
Exact Mass1792.79
IUPAC Name3-methylidene-7-(4-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-2,7-diazaspiro[4.4]nonan-1-one;3-methylidene-7-(5-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-2,7-diazaspiro[4.4]nonan-1-one;2-methylidene-7-(2-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one;2-methylidene-7-(5-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one;2-methylidene-7-(6-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one;2-methylidene-7-(7-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one
SMILES[3H]c1ccc2c(C(=O)N3CCC4(C3)NC(=C)NC4=O)cnn2c1.[3H]c1cccc2c(C(=O)N3CCC4(C3)NC(=C)NC4=O)cnn12.[3H]c1cccn2ncc(C(=O)N3CCC4(CC(=C)NC4=O)C3)c12.[3H]c1ccn2ncc(C(=O)N3CCC4(C3)NC(=C)NC4=O)c2c1.[3H]c1ccn2ncc(C(=O)N3CCC4(CC(=C)NC4=O)C3)c2c1.[3H]c1nn2ccccc2c1C(=O)N1CCC2(C1)NC(=C)NC2=O
InChIInChI=1S/2C16H16N4O2.4C15H15N5O2/c2*1-11-8-16(15(22)18-11)5-7-19(10-16)14(21)12-9-17-20-6-3-2-4-13(12)20;4*1-10-17-14(22)15(18-10)5-7-19(9-15)13(21)11-8-16-20-6-3-2-4-12(11)20/h2*2-4,6,9H,1,5,7-8,10H2,(H,18,22);4*2-4,6,8,18H,1,5,7,9H2,(H,17,22)/i4T;2T;8T;6T;3T;2T
InChIKeyIQDQCUHSSMKNKU-NWJDHSCMSA-N
XLogP2.84
TPSA448.38 Ų
H-Bond Donors10
H-Bond Acceptors28
Rotatable Bonds6
Heavy Atoms132
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001793.98
LogP ≤ 52.84
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1028

Analyze 3-methylidene-7-(4-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-2,7-diazaspiro[4.4]nonan-1-one;3-methylidene-7-(5-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-2,7-diazaspiro[4.4]nonan-1-one;2-methylidene-7-(2-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one;2-methylidene-7-(5-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one;2-methylidene-7-(6-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one;2-methylidene-7-(7-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one with MolForge

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Related Compounds

1-[1-(tert-butylcarbamoyl)piperidin-4-yl]-N-[4-(pyrazolo[1,5-a]pyridine-3-carbonylamino)phenyl]indazole-3-carboxamide
CID 155539793
5-N-tert-butyl-2-[1-[2-[(3-carbamoyl-2-pyridin-3-yl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carbonyl)amino]-2-methylpropyl]-2-fluoropyridin-1-ium-4-yl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-3,5-dicarboxamide
CID 123999990
5-[2-[(1S)-1-[[(2S)-2-(3-acetylindol-1-yl)butanoyl]amino]-2-(3,5-difluorophenyl)ethyl]-3-pyridinyl]-2-fluoro-N-methylbenzamide;5-[2-[(1S)-2-(3,5-difluorophenyl)-1-[[(2S)-4-methyl-2-[3-(trifluoromethyl)pyrazol-1-yl]pentanoyl]amino]ethyl]-3-pyridinyl]-2-fluorobenzamide;5-[2-[(1S)-2-(3,5-difluorophenyl)-1-[[(2R)-4-methyl-2-[3-(trifluoromethyl)pyrazol-1-yl]pentanoyl]amino]ethyl]-3-pyridinyl]-2-fluoro-N-methylbenzamide;5-[2-[(1S)-2-(3,5-difluorophenyl)-1-[[(2S)-2-[4-(trifluoromethyl)pyrazol-1-yl]butanoyl]amino]ethyl]-3-pyridinyl]-2-fluoro-N-methylbenzamide;5-[2-[(1S)-2-(3,5-difluorophenyl)-1-[[(2R)-2-[4-(trifluoromethyl)pyrazol-1-yl]butanoyl]amino]ethyl]-3-pyridinyl]-2-fluoro-N-methylbenzamide
CID 157579703
8-[5-(3,5-dimethylpyrazin-2-yl)-1-(4-methylphenyl)pyrazole-3-carbonyl]-1-(4-methylphenyl)-1,8-diazaspiro[4.5]decan-4-one;1-(4-methylphenyl)-8-[1-(4-methylphenyl)-5-pyridin-3-ylpyrazole-3-carbonyl]-1,8-diazaspiro[4.5]decan-4-one;bis(1-(4-methylphenyl)-8-[5-pyridin-4-yl-1-[4-(trifluoromethyl)phenyl]pyrazole-3-carbonyl]-1,3,8-triazaspiro[4.5]decan-4-one);3-[1-(1-phenyl-5-pyridin-4-ylpyrazole-3-carbonyl)piperidin-4-yl]-1H-benzimidazol-2-one
CID 158357669
Bis(8-[1-(3,4-difluorophenyl)-5-pyridin-4-ylpyrazole-3-carbonyl]-1-(4-methylphenyl)-1,3,8-triazaspiro[4.5]decan-4-one);1-[1-[1-(3,4-difluorophenyl)-5-pyridin-4-ylpyrazole-3-carbonyl]piperidin-4-yl]-3-methylbenzimidazol-2-one;8-[1-[3-fluoro-4-(trifluoromethyl)phenyl]-5-pyridin-4-ylpyrazole-3-carbonyl]-1-(4-methylphenyl)-1,3,8-triazaspiro[4.5]decan-4-one;1-methyl-3-[1-[5-pyridin-4-yl-1-[4-(trifluoromethyl)phenyl]pyrazole-3-carbonyl]piperidin-4-yl]benzimidazol-2-one
CID 158558863
[4-(6,7-difluoro-2-methylidene-3H-benzimidazol-1-yl)piperidin-1-yl]-[5-pyridin-2-yl-1-(3,4,5-trifluorophenyl)pyrazol-3-yl]methanone;[4-(6,7-difluoro-2-methylidene-3H-benzimidazol-1-yl)piperidin-1-yl]-[5-pyridin-3-yl-1-(3,4,5-trifluorophenyl)pyrazol-3-yl]methanone;[1-(4-fluorophenyl)-4-methylidene-1,3,8-triazaspiro[4.5]decan-8-yl]-[1-[3-fluoro-4-(trifluoromethyl)phenyl]-5-pyridin-3-ylpyrazol-3-yl]methanone;[5-pyridin-4-yl-1-(3,4,5-trifluorophenyl)pyrazol-3-yl]-[4-(5,6,7-trifluoro-2-methylidene-3H-benzimidazol-1-yl)piperidin-1-yl]methanone
CID 160056379
(7S)-N-[(1-methylpyrazol-4-yl)methyl]-7-propan-2-yl-6-[[4-(trifluoromethyl)phenyl]methyl]-5,7-dihydropyrrolo[3,4-b]pyridine-3-carboxamide;(7S)-N-[3-(2-oxopyrrolidin-1-yl)propyl]-7-propan-2-yl-6-[[4-(trifluoromethyl)phenyl]methyl]-5,7-dihydropyrrolo[3,4-b]pyridine-3-carboxamide;(7S)-N-(2-piperidin-1-ylethyl)-7-propan-2-yl-6-[[4-(trifluoromethyl)phenyl]methyl]-5,7-dihydropyrrolo[3,4-b]pyridine-3-carboxamide;(7S)-N-[(4-propanoylcyclohexyl)methyl]-7-propan-2-yl-6-[[4-(trifluoromethyl)phenyl]methyl]-5,7-dihydropyrrolo[3,4-b]pyridine-3-carboxamide;(7S)-7-propan-2-yl-N-(pyridin-2-ylmethyl)-6-[[4-(trifluoromethyl)phenyl]methyl]-5,7-dihydropyrrolo[3,4-b]pyridine-3-carboxamide
CID 160781267
[1-(3,4-Difluorophenyl)-4-methylidene-1,3,8-triazaspiro[4.5]decan-8-yl]-[1-[3-fluoro-4-(trifluoromethyl)phenyl]-5-pyridin-3-ylpyrazol-3-yl]methanone;[1-(3,4-difluorophenyl)-4-methylidene-1,3,8-triazaspiro[4.5]decan-8-yl]-[5-pyridin-3-yl-1-(3,4,5-trifluorophenyl)pyrazol-3-yl]methanone;[1-[3,5-difluoro-4-(trifluoromethyl)phenyl]-5-pyridin-3-ylpyrazol-3-yl]-[1-(4-fluorophenyl)-4-methylidene-1,3,8-triazaspiro[4.5]decan-8-yl]methanone;[1-(4-fluorophenyl)-4-methylidene-1,3,8-triazaspiro[4.5]decan-8-yl]-[5-pyridin-3-yl-1-(3,4,5-trifluorophenyl)pyrazol-3-yl]methanone
CID 161126178
8-[1-[3-Fluoro-4-(trifluoromethyl)phenyl]-5-pyridin-4-ylpyrazole-3-carbonyl]-1-(4-methylphenyl)-1,3,8-triazaspiro[4.5]decan-4-one;1-[1-[1-[3-fluoro-4-(trifluoromethyl)phenyl]-5-pyridin-4-ylpyrazole-3-carbonyl]piperidin-4-yl]-3-methylbenzimidazol-2-one;bis(1-(4-methylphenyl)-8-[5-pyridin-4-yl-1-[6-(trifluoromethyl)-3-pyridinyl]pyrazole-3-carbonyl]-1,3,8-triazaspiro[4.5]decan-4-one);1-methyl-3-[1-[5-pyridin-4-yl-1-[6-(trifluoromethyl)-3-pyridinyl]pyrazole-3-carbonyl]piperidin-4-yl]benzimidazol-2-one
CID 161406634
N-cyclopropyl-4-(13,20-dioxo-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaen-16-yl)piperidine-1-carboxamide;16-[1-(2,2-difluorocyclopropanecarbonyl)piperidin-4-yl]-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione;16-(1-methylsulfonylpiperidin-4-yl)-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione
CID 161433810
5-[2-[(1S)-1-[[(2R)-2-[3,5-bis(difluoromethyl)pyrazol-1-yl]butanoyl]amino]-2-(3,5-difluorophenyl)ethyl]-3-pyridinyl]-2-fluorobenzamide;5-[2-[(1S)-2-(3,5-difluorophenyl)-1-[[(2R)-2-[3-(trifluoromethyl)pyrazol-1-yl]hexanoyl]amino]ethyl]-3-pyridinyl]-2-fluorobenzamide;5-[2-[(1S)-2-(3,5-difluorophenyl)-1-[[(2S)-2-[3-(trifluoromethyl)pyrazol-1-yl]hexanoyl]amino]ethyl]-3-pyridinyl]-2-fluoro-N-methylbenzamide;5-[2-[(1S)-2-(3,5-difluorophenyl)-1-[[(2R)-2-[3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-1-yl]butanoyl]amino]ethyl]-3-pyridinyl]-2-fluorobenzamide;5-[2-[(1S)-2-(3,5-difluorophenyl)-1-[[(2S)-2-[3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-1-yl]butanoyl]amino]ethyl]-3-pyridinyl]-2-fluoro-N-methylbenzamide
CID 161462262
bis(N-(4-ethylcyclohexyl)-4-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[1,5-a]pyridine-3-carboxamide);N-(4-ethylphenyl)-4-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[1,5-a]pyridine-3-carboxamide;N-[4-(1-methylcyclopropyl)phenyl]-4-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[1,5-a]pyridine-3-carboxamide;bis(N-(4-methylphenyl)-4-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[1,5-a]pyridine-3-carboxamide);tris(N-(4-propan-2-ylphenyl)-4-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[1,5-a]pyridine-3-carboxamide)
CID 167684745

Frequently Asked Questions

What is the IUPAC name of 3-methylidene-7-(4-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-2,7-diazaspiro[4.4]nonan-1-one;3-methylidene-7-(5-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-2,7-diazaspiro[4.4]nonan-1-one;2-methylidene-7-(2-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one;2-methylidene-7-(5-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one;2-methylidene-7-(6-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one;2-methylidene-7-(7-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one?
The IUPAC name of 3-methylidene-7-(4-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-2,7-diazaspiro[4.4]nonan-1-one;3-methylidene-7-(5-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-2,7-diazaspiro[4.4]nonan-1-one;2-methylidene-7-(2-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one;2-methylidene-7-(5-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one;2-methylidene-7-(6-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one;2-methylidene-7-(7-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one (CID 158773332) is 3-methylidene-7-(4-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-2,7-diazaspiro[4.4]nonan-1-one;3-methylidene-7-(5-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-2,7-diazaspiro[4.4]nonan-1-one;2-methylidene-7-(2-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one;2-methylidene-7-(5-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one;2-methylidene-7-(6-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one;2-methylidene-7-(7-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one.
What is the SMILES notation for 3-methylidene-7-(4-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-2,7-diazaspiro[4.4]nonan-1-one;3-methylidene-7-(5-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-2,7-diazaspiro[4.4]nonan-1-one;2-methylidene-7-(2-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one;2-methylidene-7-(5-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one;2-methylidene-7-(6-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one;2-methylidene-7-(7-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one?
The canonical SMILES for 3-methylidene-7-(4-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-2,7-diazaspiro[4.4]nonan-1-one;3-methylidene-7-(5-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-2,7-diazaspiro[4.4]nonan-1-one;2-methylidene-7-(2-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one;2-methylidene-7-(5-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one;2-methylidene-7-(6-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one;2-methylidene-7-(7-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one is [3H]c1ccc2c(C(=O)N3CCC4(C3)NC(=C)NC4=O)cnn2c1.[3H]c1cccc2c(C(=O)N3CCC4(C3)NC(=C)NC4=O)cnn12.[3H]c1cccn2ncc(C(=O)N3CCC4(CC(=C)NC4=O)C3)c12.[3H]c1ccn2ncc(C(=O)N3CCC4(C3)NC(=C)NC4=O)c2c1.[3H]c1ccn2ncc(C(=O)N3CCC4(CC(=C)NC4=O)C3)c2c1.[3H]c1nn2ccccc2c1C(=O)N1CCC2(C1)NC(=C)NC2=O.
What is the InChIKey of 3-methylidene-7-(4-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-2,7-diazaspiro[4.4]nonan-1-one;3-methylidene-7-(5-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-2,7-diazaspiro[4.4]nonan-1-one;2-methylidene-7-(2-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one;2-methylidene-7-(5-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one;2-methylidene-7-(6-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one;2-methylidene-7-(7-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one?
The InChIKey is IQDQCUHSSMKNKU-NWJDHSCMSA-N. The full InChI is InChI=1S/2C16H16N4O2.4C15H15N5O2/c2*1-11-8-16(15(22)18-11)5-7-19(10-16)14(21)12-9-17-20-6-3-2-4-13(12)20;4*1-10-17-14(22)15(18-10)5-7-19(9-15)13(21)11-8-16-20-6-3-2-4-12(11)20/h2*2-4,6,9H,1,5,7-8,10H2,(H,18,22);4*2-4,6,8,18H,1,5,7,9H2,(H,17,22)/i4T;2T;8T;6T;3T;2T.
What are the key properties of 3-methylidene-7-(4-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-2,7-diazaspiro[4.4]nonan-1-one;3-methylidene-7-(5-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-2,7-diazaspiro[4.4]nonan-1-one;2-methylidene-7-(2-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one;2-methylidene-7-(5-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one;2-methylidene-7-(6-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one;2-methylidene-7-(7-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one?
3-methylidene-7-(4-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-2,7-diazaspiro[4.4]nonan-1-one;3-methylidene-7-(5-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-2,7-diazaspiro[4.4]nonan-1-one;2-methylidene-7-(2-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one;2-methylidene-7-(5-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one;2-methylidene-7-(6-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one;2-methylidene-7-(7-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one has a molecular weight of 1793.98 g/mol, XLogP of 2.84, 6 rotatable bonds, 10 hydrogen bond donors, and 28 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methylidene-7-(4-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-2,7-diazaspiro[4.4]nonan-1-one;3-methylidene-7-(5-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-2,7-diazaspiro[4.4]nonan-1-one;2-methylidene-7-(2-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one;2-methylidene-7-(5-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one;2-methylidene-7-(6-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one;2-methylidene-7-(7-tritiopyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one is sourced from PubChem (CID 158773332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).