[(1S)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(1H-indazol-3-yl)methanone;[(1R)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(1H-indazol-3-yl)methanone;[(1R)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(1H-indazol-3-yl)methanone;[(1S)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(1H-indazol-3-yl)methanone;[(1S)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(6-methyl-1H-indazol-3-yl)methanone;[(1R)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(6-methyl-1H-indazol-3-yl)methanone;[(1R)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(6-methyl-1H-indazol-3-yl)methanone;bis([(1S)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(6-methyl-1H-indazol-3-yl)methanone)

C149H172N36O9 — CID 157259218

IUPAC[(1S)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(1H-indazol-3-yl)methanone;[(1R)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(1H-indazol-3-yl)methanone;[(1R)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(1H-indazol-3-yl)methanone;[(1S)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(1H-indazol-3-yl)methanone;[(1S)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(6-methyl-1H-indazol-3-yl)methanone;[(1R)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(6-methyl-1H-indazol-3-yl)methanone;[(1R)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(6-methyl-1H-indazol-3-yl)methanone;bis([(1S)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(6-methyl-1H-indazol-3-yl)methanone)
SMILESCc1ccc2c(C(=O)N3C4CCN5CC4C[C@@H]3C5)n[nH]c2c1.Cc1ccc2c(C(=O)N3C4CCN5CC4C[C@H]3C5)n[nH]c2c1.Cc1ccc2c(C(=O)N3C4CN5CCC4C[C@@H]3C5)n[nH]c2c1.Cc1ccc2c(C(=O)N3C4CN5CCC4C[C@H]3C5)n[nH]c2c1.Cc1ccc2c(C(=O)N3C4CN5CCC4C[C@H]3C5)n[nH]c2c1.O=C(c1n[nH]c2ccccc12)N1C2CCN3CC2C[C@@H]1C3.O=C(c1n[nH]c2ccccc12)N1C2CCN3CC2C[C@H]1C3.O=C(c1n[nH]c2ccccc12)N1C2CN3CCC2C[C@@H]1C3.O=C(c1n[nH]c2ccccc12)N1C2CN3CCC2C[C@H]1C3
InChIInChI=1S/5C17H20N4O.4C16H18N4O/c2*1-10-2-3-13-14(6-10)18-19-16(13)17(22)21-12-7-11-8-20(9-12)5-4-15(11)21;3*1-10-2-3-13-14(6-10)18-19-16(13)17(22)21-12-7-11-4-5-20(8-12)9-15(11)21;2*21-16(15-12-3-1-2-4-13(12)17-18-15)20-11-7-10-8-19(9-11)6-5-14(10)20;2*21-16(15-12-3-1-2-4-13(12)17-18-15)20-11-7-10-5-6-19(8-11)9-14(10)20/h5*2-3,6,11-12,15H,4-5,7-9H2,1H3,(H,18,19);4*1-4,10-11,14H,5-9H2,(H,17,18)/t5*11?,12-,15?;4*10?,11-,14?/m101001010/s1
InChIKeyAXGLPIFBFSHZSG-KBGMKJLMSA-N
MW2611.26 g/mol
LogP14.88
Rot. Bonds9

About [(1S)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(1H-indazol-3-yl)methanone;[(1R)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(1H-indazol-3-yl)methanone;[(1R)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(1H-indazol-3-yl)methanone;[(1S)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(1H-indazol-3-yl)methanone;[(1S)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(6-methyl-1H-indazol-3-yl)methanone;[(1R)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(6-methyl-1H-indazol-3-yl)methanone;[(1R)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(6-methyl-1H-indazol-3-yl)methanone;bis([(1S)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(6-methyl-1H-indazol-3-yl)methanone)

[(1S)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(1H-indazol-3-yl)methanone;[(1R)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(1H-indazol-3-yl)methanone;[(1R)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(1H-indazol-3-yl)methanone;[(1S)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(1H-indazol-3-yl)methanone;[(1S)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(6-methyl-1H-indazol-3-yl)methanone;[(1R)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(6-methyl-1H-indazol-3-yl)methanone;[(1R)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(6-methyl-1H-indazol-3-yl)methanone;bis([(1S)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(6-methyl-1H-indazol-3-yl)methanone) (PubChem CID 157259218) has the molecular formula C149H172N36O9 and a molecular weight of 2611.26 g/mol. Its IUPAC name is [(1S)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(1H-indazol-3-yl)methanone;[(1R)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(1H-indazol-3-yl)methanone;[(1R)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(1H-indazol-3-yl)methanone;[(1S)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(1H-indazol-3-yl)methanone;[(1S)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(6-methyl-1H-indazol-3-yl)methanone;[(1R)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(6-methyl-1H-indazol-3-yl)methanone;[(1R)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(6-methyl-1H-indazol-3-yl)methanone;bis([(1S)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(6-methyl-1H-indazol-3-yl)methanone).

Molecular Properties

Compound Name[(1S)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(1H-indazol-3-yl)methanone;[(1R)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(1H-indazol-3-yl)methanone;[(1R)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(1H-indazol-3-yl)methanone;[(1S)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(1H-indazol-3-yl)methanone;[(1S)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(6-methyl-1H-indazol-3-yl)methanone;[(1R)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(6-methyl-1H-indazol-3-yl)methanone;[(1R)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(6-methyl-1H-indazol-3-yl)methanone;bis([(1S)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(6-methyl-1H-indazol-3-yl)methanone)
PubChem CID157259218
Molecular FormulaC149H172N36O9
Molecular Weight2611.26 g/mol
Exact Mass2609.41
IUPAC Name[(1S)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(1H-indazol-3-yl)methanone;[(1R)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(1H-indazol-3-yl)methanone;[(1R)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(1H-indazol-3-yl)methanone;[(1S)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(1H-indazol-3-yl)methanone;[(1S)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(6-methyl-1H-indazol-3-yl)methanone;[(1R)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(6-methyl-1H-indazol-3-yl)methanone;[(1R)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(6-methyl-1H-indazol-3-yl)methanone;bis([(1S)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(6-methyl-1H-indazol-3-yl)methanone)
SMILESCc1ccc2c(C(=O)N3C4CCN5CC4C[C@@H]3C5)n[nH]c2c1.Cc1ccc2c(C(=O)N3C4CCN5CC4C[C@H]3C5)n[nH]c2c1.Cc1ccc2c(C(=O)N3C4CN5CCC4C[C@@H]3C5)n[nH]c2c1.Cc1ccc2c(C(=O)N3C4CN5CCC4C[C@H]3C5)n[nH]c2c1.Cc1ccc2c(C(=O)N3C4CN5CCC4C[C@H]3C5)n[nH]c2c1.O=C(c1n[nH]c2ccccc12)N1C2CCN3CC2C[C@@H]1C3.O=C(c1n[nH]c2ccccc12)N1C2CCN3CC2C[C@H]1C3.O=C(c1n[nH]c2ccccc12)N1C2CN3CCC2C[C@@H]1C3.O=C(c1n[nH]c2ccccc12)N1C2CN3CCC2C[C@H]1C3
InChIInChI=1S/5C17H20N4O.4C16H18N4O/c2*1-10-2-3-13-14(6-10)18-19-16(13)17(22)21-12-7-11-8-20(9-12)5-4-15(11)21;3*1-10-2-3-13-14(6-10)18-19-16(13)17(22)21-12-7-11-4-5-20(8-12)9-15(11)21;2*21-16(15-12-3-1-2-4-13(12)17-18-15)20-11-7-10-8-19(9-11)6-5-14(10)20;2*21-16(15-12-3-1-2-4-13(12)17-18-15)20-11-7-10-5-6-19(8-11)9-14(10)20/h5*2-3,6,11-12,15H,4-5,7-9H2,1H3,(H,18,19);4*1-4,10-11,14H,5-9H2,(H,17,18)/t5*11?,12-,15?;4*10?,11-,14?/m101001010/s1
InChIKeyAXGLPIFBFSHZSG-KBGMKJLMSA-N
XLogP14.88
TPSA470.07 Ų
H-Bond Donors9
H-Bond Acceptors27
Rotatable Bonds9
Heavy Atoms194
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002611.26
LogP ≤ 514.88
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1027

Analyze [(1S)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(1H-indazol-3-yl)methanone;[(1R)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(1H-indazol-3-yl)methanone;[(1R)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(1H-indazol-3-yl)methanone;[(1S)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(1H-indazol-3-yl)methanone;[(1S)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(6-methyl-1H-indazol-3-yl)methanone;[(1R)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(6-methyl-1H-indazol-3-yl)methanone;[(1R)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(6-methyl-1H-indazol-3-yl)methanone;bis([(1S)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(6-methyl-1H-indazol-3-yl)methanone) with MolForge

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Related Compounds

[5-(3-aminoprop-1-en-2-yl)-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepin-3-yl]-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;1-[3-[4-[2-(trifluoromethyl)phenyl]piperidine-1-carbonyl]-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazol-5-yl]ethanone;bis(1-[3-[4-[2-(trifluoromethyl)phenyl]piperidine-1-carbonyl]-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl]ethanone);1-[3-[4-[2-(trifluoromethyl)phenyl]piperidine-1-carbonyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl]ethanone
CID 157126843
1-[3-[4-[2-(trifluoromethyl)phenyl]piperidine-1-carbonyl]-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazol-5-yl]propan-1-one;bis(1-[3-[4-[2-(trifluoromethyl)phenyl]piperidine-1-carbonyl]-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepin-5-yl]propan-1-one);1-[3-[4-[2-(trifluoromethyl)phenyl]piperidine-1-carbonyl]-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl]propan-1-one;1-[3-[4-[2-(trifluoromethyl)phenyl]piperidine-1-carbonyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl]propan-1-one
CID 157879272
(5-ethyl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazol-3-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(5-ethyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(6-ethyl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-3-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(5-propyl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepin-3-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone
CID 157915017
(1,5-dimethylindazol-3-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(1,6-dimethylindazol-3-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(1-ethyl-5-methylindazol-3-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(1-ethyl-6-methylindazol-3-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;1H-indazol-3-yl-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(1-methylindazol-3-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(5-methyl-1H-indazol-3-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(6-methyl-1H-indazol-3-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone
CID 158028316
[5-(3-aminoprop-1-en-2-yl)-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepin-3-yl]-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;1-[3-[4-[2-(trifluoromethyl)phenyl]piperidine-1-carbonyl]-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazol-5-yl]ethanone;1-[3-[4-[2-(trifluoromethyl)phenyl]piperidine-1-carbonyl]-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl]ethanone;bis(1-[3-[4-[2-(trifluoromethyl)phenyl]piperidine-1-carbonyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl]ethanone)
CID 158146163
(5-ethyl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazol-3-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(5-ethyl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepin-3-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(5-ethyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;bis((6-ethyl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-3-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone)
CID 158529912
(1,5-dimethylindazol-3-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(1,6-dimethylindazol-3-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;1H-indazol-3-yl-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(1-methylindazol-3-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(5-methyl-1H-indazol-3-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(6-methyl-1H-indazol-3-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone
CID 158641946
(1,6-dimethylindazol-3-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(1-ethyl-5-fluoroindazol-3-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(1-ethyl-6-methylindazol-3-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(5-fluoro-1H-indazol-3-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(5-fluoro-1-methylindazol-3-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;1H-indazol-3-yl-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(1-methylindazol-3-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(6-methyl-1H-indazol-3-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone
CID 158832203
(6-Cyclobutyl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-3-yl)-[4-[3-fluoro-2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;1-[3-[4-[3,4-difluoro-2-(trifluoromethyl)phenyl]piperidine-1-carbonyl]-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl]ethanone;bis(1-[3-[4-[3,4-difluoro-2-(trifluoromethyl)phenyl]piperidine-1-carbonyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl]ethanone);[4-[3-fluoro-2-(trifluoromethyl)phenyl]piperidin-1-yl]-(6-methyl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-3-yl)methanone;[4-[3-fluoro-2-(trifluoromethyl)phenyl]piperidin-1-yl]-(6-propyl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-3-yl)methanone
CID 159290933
1-[3-[4-[2-(trifluoromethyl)phenyl]piperidine-1-carbonyl]-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazol-5-yl]propan-1-one;1-[3-[4-[2-(trifluoromethyl)phenyl]piperidine-1-carbonyl]-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepin-5-yl]propan-1-one;1-[3-[4-[2-(trifluoromethyl)phenyl]piperidine-1-carbonyl]-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl]propan-1-one;1-[3-[4-[2-(trifluoromethyl)phenyl]piperidine-1-carbonyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl]propan-1-one
CID 159315799
(5-propyl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazol-3-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(5-propyl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepin-3-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(5-propyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(6-propyl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-3-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone
CID 159729523
(5-ethyl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazol-3-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(5-ethyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(6-ethyl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-3-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(5-propyl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepin-3-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(5-propyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone
CID 160019104

Frequently Asked Questions

What is the IUPAC name of [(1S)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(1H-indazol-3-yl)methanone;[(1R)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(1H-indazol-3-yl)methanone;[(1R)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(1H-indazol-3-yl)methanone;[(1S)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(1H-indazol-3-yl)methanone;[(1S)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(6-methyl-1H-indazol-3-yl)methanone;[(1R)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(6-methyl-1H-indazol-3-yl)methanone;[(1R)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(6-methyl-1H-indazol-3-yl)methanone;bis([(1S)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(6-methyl-1H-indazol-3-yl)methanone)?
The IUPAC name of [(1S)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(1H-indazol-3-yl)methanone;[(1R)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(1H-indazol-3-yl)methanone;[(1R)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(1H-indazol-3-yl)methanone;[(1S)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(1H-indazol-3-yl)methanone;[(1S)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(6-methyl-1H-indazol-3-yl)methanone;[(1R)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(6-methyl-1H-indazol-3-yl)methanone;[(1R)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(6-methyl-1H-indazol-3-yl)methanone;bis([(1S)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(6-methyl-1H-indazol-3-yl)methanone) (CID 157259218) is [(1S)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(1H-indazol-3-yl)methanone;[(1R)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(1H-indazol-3-yl)methanone;[(1R)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(1H-indazol-3-yl)methanone;[(1S)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(1H-indazol-3-yl)methanone;[(1S)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(6-methyl-1H-indazol-3-yl)methanone;[(1R)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(6-methyl-1H-indazol-3-yl)methanone;[(1R)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(6-methyl-1H-indazol-3-yl)methanone;bis([(1S)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(6-methyl-1H-indazol-3-yl)methanone).
What is the SMILES notation for [(1S)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(1H-indazol-3-yl)methanone;[(1R)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(1H-indazol-3-yl)methanone;[(1R)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(1H-indazol-3-yl)methanone;[(1S)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(1H-indazol-3-yl)methanone;[(1S)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(6-methyl-1H-indazol-3-yl)methanone;[(1R)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(6-methyl-1H-indazol-3-yl)methanone;[(1R)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(6-methyl-1H-indazol-3-yl)methanone;bis([(1S)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(6-methyl-1H-indazol-3-yl)methanone)?
The canonical SMILES for [(1S)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(1H-indazol-3-yl)methanone;[(1R)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(1H-indazol-3-yl)methanone;[(1R)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(1H-indazol-3-yl)methanone;[(1S)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(1H-indazol-3-yl)methanone;[(1S)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(6-methyl-1H-indazol-3-yl)methanone;[(1R)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(6-methyl-1H-indazol-3-yl)methanone;[(1R)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(6-methyl-1H-indazol-3-yl)methanone;bis([(1S)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(6-methyl-1H-indazol-3-yl)methanone) is Cc1ccc2c(C(=O)N3C4CCN5CC4C[C@@H]3C5)n[nH]c2c1.Cc1ccc2c(C(=O)N3C4CCN5CC4C[C@H]3C5)n[nH]c2c1.Cc1ccc2c(C(=O)N3C4CN5CCC4C[C@@H]3C5)n[nH]c2c1.Cc1ccc2c(C(=O)N3C4CN5CCC4C[C@H]3C5)n[nH]c2c1.Cc1ccc2c(C(=O)N3C4CN5CCC4C[C@H]3C5)n[nH]c2c1.O=C(c1n[nH]c2ccccc12)N1C2CCN3CC2C[C@@H]1C3.O=C(c1n[nH]c2ccccc12)N1C2CCN3CC2C[C@H]1C3.O=C(c1n[nH]c2ccccc12)N1C2CN3CCC2C[C@@H]1C3.O=C(c1n[nH]c2ccccc12)N1C2CN3CCC2C[C@H]1C3.
What is the InChIKey of [(1S)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(1H-indazol-3-yl)methanone;[(1R)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(1H-indazol-3-yl)methanone;[(1R)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(1H-indazol-3-yl)methanone;[(1S)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(1H-indazol-3-yl)methanone;[(1S)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(6-methyl-1H-indazol-3-yl)methanone;[(1R)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(6-methyl-1H-indazol-3-yl)methanone;[(1R)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(6-methyl-1H-indazol-3-yl)methanone;bis([(1S)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(6-methyl-1H-indazol-3-yl)methanone)?
The InChIKey is AXGLPIFBFSHZSG-KBGMKJLMSA-N. The full InChI is InChI=1S/5C17H20N4O.4C16H18N4O/c2*1-10-2-3-13-14(6-10)18-19-16(13)17(22)21-12-7-11-8-20(9-12)5-4-15(11)21;3*1-10-2-3-13-14(6-10)18-19-16(13)17(22)21-12-7-11-4-5-20(8-12)9-15(11)21;2*21-16(15-12-3-1-2-4-13(12)17-18-15)20-11-7-10-8-19(9-11)6-5-14(10)20;2*21-16(15-12-3-1-2-4-13(12)17-18-15)20-11-7-10-5-6-19(8-11)9-14(10)20/h5*2-3,6,11-12,15H,4-5,7-9H2,1H3,(H,18,19);4*1-4,10-11,14H,5-9H2,(H,17,18)/t5*11?,12-,15?;4*10?,11-,14?/m101001010/s1.
What are the key properties of [(1S)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(1H-indazol-3-yl)methanone;[(1R)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(1H-indazol-3-yl)methanone;[(1R)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(1H-indazol-3-yl)methanone;[(1S)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(1H-indazol-3-yl)methanone;[(1S)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(6-methyl-1H-indazol-3-yl)methanone;[(1R)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(6-methyl-1H-indazol-3-yl)methanone;[(1R)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(6-methyl-1H-indazol-3-yl)methanone;bis([(1S)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(6-methyl-1H-indazol-3-yl)methanone)?
[(1S)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(1H-indazol-3-yl)methanone;[(1R)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(1H-indazol-3-yl)methanone;[(1R)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(1H-indazol-3-yl)methanone;[(1S)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(1H-indazol-3-yl)methanone;[(1S)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(6-methyl-1H-indazol-3-yl)methanone;[(1R)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(6-methyl-1H-indazol-3-yl)methanone;[(1R)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(6-methyl-1H-indazol-3-yl)methanone;bis([(1S)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(6-methyl-1H-indazol-3-yl)methanone) has a molecular weight of 2611.26 g/mol, XLogP of 14.88, 9 rotatable bonds, 9 hydrogen bond donors, and 27 hydrogen bond acceptors.
Where does this data come from?
All data for [(1S)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(1H-indazol-3-yl)methanone;[(1R)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(1H-indazol-3-yl)methanone;[(1R)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(1H-indazol-3-yl)methanone;[(1S)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(1H-indazol-3-yl)methanone;[(1S)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(6-methyl-1H-indazol-3-yl)methanone;[(1R)-2,6-diazatricyclo[4.3.1.03,8]decan-2-yl]-(6-methyl-1H-indazol-3-yl)methanone;[(1R)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(6-methyl-1H-indazol-3-yl)methanone;bis([(1S)-6,9-diazatricyclo[4.3.1.03,8]decan-9-yl]-(6-methyl-1H-indazol-3-yl)methanone) is sourced from PubChem (CID 157259218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).