5-fluoro-N,N-dimethyl-1'-(1-pyridin-2-ylpiperidin-4-yl)spiro[2H-indole-3,4'-piperidine]-1-carboxamide;5-fluoro-N,N-dimethyl-1'-(1-pyrimidin-5-ylpiperidin-4-yl)spiro[2H-indole-3,4'-piperidine]-1-carboxamide;5-fluoro-N,N-dimethyl-1'-[1-(1,3-thiazol-2-yl)piperidin-4-yl]spiro[2H-indole-3,4'-piperidine]-1-carboxamide

C72H93F3N16O3S — CID 157398266

IUPAC5-fluoro-N,N-dimethyl-1'-(1-pyridin-2-ylpiperidin-4-yl)spiro[2H-indole-3,4'-piperidine]-1-carboxamide;5-fluoro-N,N-dimethyl-1'-(1-pyrimidin-5-ylpiperidin-4-yl)spiro[2H-indole-3,4'-piperidine]-1-carboxamide;5-fluoro-N,N-dimethyl-1'-[1-(1,3-thiazol-2-yl)piperidin-4-yl]spiro[2H-indole-3,4'-piperidine]-1-carboxamide
SMILESCN(C)C(=O)N1CC2(CCN(C3CCN(c4ccccn4)CC3)CC2)c2cc(F)ccc21.CN(C)C(=O)N1CC2(CCN(C3CCN(c4cncnc4)CC3)CC2)c2cc(F)ccc21.CN(C)C(=O)N1CC2(CCN(C3CCN(c4nccs4)CC3)CC2)c2cc(F)ccc21
InChIInChI=1S/C25H32FN5O.C24H31FN6O.C23H30FN5OS/c1-28(2)24(32)31-18-25(21-17-19(26)6-7-22(21)31)10-15-29(16-11-25)20-8-13-30(14-9-20)23-5-3-4-12-27-23;1-28(2)23(32)31-16-24(21-13-18(25)3-4-22(21)31)7-11-30(12-8-24)19-5-9-29(10-6-19)20-14-26-17-27-15-20;1-26(2)22(30)29-16-23(19-15-17(24)3-4-20(19)29)7-12-27(13-8-23)18-5-10-28(11-6-18)21-25-9-14-31-21/h3-7,12,17,20H,8-11,13-16,18H2,1-2H3;3-4,13-15,17,19H,5-12,16H2,1-2H3;3-4,9,14-15,18H,5-8,10-13,16H2,1-2H3
InChIKeyBMVKXFRUMNXXBZ-UHFFFAOYSA-N
MW1319.71 g/mol
LogP10.63
Rot. Bonds6

About 5-fluoro-N,N-dimethyl-1'-(1-pyridin-2-ylpiperidin-4-yl)spiro[2H-indole-3,4'-piperidine]-1-carboxamide;5-fluoro-N,N-dimethyl-1'-(1-pyrimidin-5-ylpiperidin-4-yl)spiro[2H-indole-3,4'-piperidine]-1-carboxamide;5-fluoro-N,N-dimethyl-1'-[1-(1,3-thiazol-2-yl)piperidin-4-yl]spiro[2H-indole-3,4'-piperidine]-1-carboxamide

5-fluoro-N,N-dimethyl-1'-(1-pyridin-2-ylpiperidin-4-yl)spiro[2H-indole-3,4'-piperidine]-1-carboxamide;5-fluoro-N,N-dimethyl-1'-(1-pyrimidin-5-ylpiperidin-4-yl)spiro[2H-indole-3,4'-piperidine]-1-carboxamide;5-fluoro-N,N-dimethyl-1'-[1-(1,3-thiazol-2-yl)piperidin-4-yl]spiro[2H-indole-3,4'-piperidine]-1-carboxamide (PubChem CID 157398266) has the molecular formula C72H93F3N16O3S and a molecular weight of 1319.71 g/mol. Its IUPAC name is 5-fluoro-N,N-dimethyl-1'-(1-pyridin-2-ylpiperidin-4-yl)spiro[2H-indole-3,4'-piperidine]-1-carboxamide;5-fluoro-N,N-dimethyl-1'-(1-pyrimidin-5-ylpiperidin-4-yl)spiro[2H-indole-3,4'-piperidine]-1-carboxamide;5-fluoro-N,N-dimethyl-1'-[1-(1,3-thiazol-2-yl)piperidin-4-yl]spiro[2H-indole-3,4'-piperidine]-1-carboxamide.

Molecular Properties

Compound Name5-fluoro-N,N-dimethyl-1'-(1-pyridin-2-ylpiperidin-4-yl)spiro[2H-indole-3,4'-piperidine]-1-carboxamide;5-fluoro-N,N-dimethyl-1'-(1-pyrimidin-5-ylpiperidin-4-yl)spiro[2H-indole-3,4'-piperidine]-1-carboxamide;5-fluoro-N,N-dimethyl-1'-[1-(1,3-thiazol-2-yl)piperidin-4-yl]spiro[2H-indole-3,4'-piperidine]-1-carboxamide
PubChem CID157398266
Molecular FormulaC72H93F3N16O3S
Molecular Weight1319.71 g/mol
Exact Mass1318.73
IUPAC Name5-fluoro-N,N-dimethyl-1'-(1-pyridin-2-ylpiperidin-4-yl)spiro[2H-indole-3,4'-piperidine]-1-carboxamide;5-fluoro-N,N-dimethyl-1'-(1-pyrimidin-5-ylpiperidin-4-yl)spiro[2H-indole-3,4'-piperidine]-1-carboxamide;5-fluoro-N,N-dimethyl-1'-[1-(1,3-thiazol-2-yl)piperidin-4-yl]spiro[2H-indole-3,4'-piperidine]-1-carboxamide
SMILESCN(C)C(=O)N1CC2(CCN(C3CCN(c4ccccn4)CC3)CC2)c2cc(F)ccc21.CN(C)C(=O)N1CC2(CCN(C3CCN(c4cncnc4)CC3)CC2)c2cc(F)ccc21.CN(C)C(=O)N1CC2(CCN(C3CCN(c4nccs4)CC3)CC2)c2cc(F)ccc21
InChIInChI=1S/C25H32FN5O.C24H31FN6O.C23H30FN5OS/c1-28(2)24(32)31-18-25(21-17-19(26)6-7-22(21)31)10-15-29(16-11-25)20-8-13-30(14-9-20)23-5-3-4-12-27-23;1-28(2)23(32)31-16-24(21-13-18(25)3-4-22(21)31)7-11-30(12-8-24)19-5-9-29(10-6-19)20-14-26-17-27-15-20;1-26(2)22(30)29-16-23(19-15-17(24)3-4-20(19)29)7-12-27(13-8-23)18-5-10-28(11-6-18)21-25-9-14-31-21/h3-7,12,17,20H,8-11,13-16,18H2,1-2H3;3-4,13-15,17,19H,5-12,16H2,1-2H3;3-4,9,14-15,18H,5-8,10-13,16H2,1-2H3
InChIKeyBMVKXFRUMNXXBZ-UHFFFAOYSA-N
XLogP10.63
TPSA141.65 Ų
H-Bond Donors
H-Bond Acceptors14
Rotatable Bonds6
Heavy Atoms95
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001319.71
LogP ≤ 510.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1014

Analyze 5-fluoro-N,N-dimethyl-1'-(1-pyridin-2-ylpiperidin-4-yl)spiro[2H-indole-3,4'-piperidine]-1-carboxamide;5-fluoro-N,N-dimethyl-1'-(1-pyrimidin-5-ylpiperidin-4-yl)spiro[2H-indole-3,4'-piperidine]-1-carboxamide;5-fluoro-N,N-dimethyl-1'-[1-(1,3-thiazol-2-yl)piperidin-4-yl]spiro[2H-indole-3,4'-piperidine]-1-carboxamide with MolForge

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Related Compounds

6-(4-methyl-3-pyridinyl)-2-(4-piperidin-1-ylpiperidin-1-yl)-[1,3]thiazolo[4,5-b]pyridine;N-[2-[2-(4-piperidin-1-ylpiperidin-1-yl)-[1,3]thiazolo[4,5-b]pyridin-6-yl]phenyl]acetamide;N-[3-[2-(4-piperidin-1-ylpiperidin-1-yl)-[1,3]thiazolo[4,5-b]pyridin-6-yl]phenyl]acetamide;7-[2-(4-piperidin-1-ylpiperidin-1-yl)-[1,3]thiazolo[4,5-c]pyridin-6-yl]pyrido[1,2-a]pyrimidin-4-one;5-[2-(4-piperidin-1-ylpiperidin-1-yl)-[1,3]thiazolo[4,5-c]pyridin-6-yl]pyrimidin-2-amine;5-[2-(4-piperidin-1-ylpiperidin-1-yl)-[1,3]thiazolo[4,5-c]pyridin-6-yl]-4-(trifluoromethyl)pyrimidin-2-amine
CID 157193776
1-[4-[2-[3,5-Bis(trifluoromethyl)phenyl]-1,3-thiazol-5-yl]piperidin-1-yl]-2-imidazo[4,5-c]pyridin-1-ylethanone;1-[4-[2-[3,5-bis(trifluoromethyl)phenyl]-1,3-thiazol-5-yl]piperidin-1-yl]-2-imidazo[4,5-c]pyridin-3-ylethanone;methane
CID 157674150
2-[4-[2-amino-8-(4-fluorophenyl)-7H-purin-6-yl]piperazin-1-yl]-N-pyridin-2-ylacetamide;2-[4-[2-amino-8-(4-fluorophenyl)-7H-purin-6-yl]piperazin-1-yl]-N-(1,3-thiazol-2-yl)acetamide;8-(4-fluorophenyl)-6-[4-(4-fluorophenyl)piperazin-1-yl]-7H-purin-2-amine
CID 87282611
1'-[1-(3,6-dimethylpyrazin-2-yl)piperidin-4-yl]-5-fluoro-N,N-dimethylspiro[2H-indole-3,4'-piperidine]-1-carboxamide;1'-[1-(3-ethylpyrazin-2-yl)piperidin-4-yl]-5-fluoro-N,N-dimethylspiro[2H-indole-3,4'-piperidine]-1-carboxamide;1-[5-fluoro-1'-[1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]spiro[2H-indole-3,4'-piperidine]-1-yl]ethanone
CID 157099584
decakis(iridium);8-methanidyl-9-(2-methylphenyl)-7-phenyl-8H-purine;8-methanidyl-7-methyl-9-phenyl-8H-purine;8-methanidyl-9-methyl-7-phenyl-8H-purine;8-methanidyl-9-phenyl-7-phenyl-8H-purine;8-methanidyl-7-phenyl-9-propan-2-yl-8H-purine;8-methanidyl-9-phenyl-7-propan-2-yl-8H-purine;8-methanidyl-7-phenyl-9-pyridin-2-yl-8H-purine;8-methanidyl-9-phenyl-7-pyridin-4-yl-8H-purine;8-methanidyl-7-phenyl-9-thiophen-2-yl-8H-purine;8-methanidyl-9-phenyl-7-thiophen-2-yl-8H-purine
CID 157316625
1'-(1-acetylpiperidin-4-yl)-5-fluoro-N,N-dimethylspiro[2H-indole-3,4'-piperidine]-1-carboxamide;2,2-difluoroethyl 4-[1-(dimethylcarbamoyl)-5-fluorospiro[2H-indole-3,4'-piperidine]-1'-yl]piperidine-1-carboxylate;ethyl 4-[5-fluoro-1-(1,3-thiazol-2-yl)spiro[2H-indole-3,4'-piperidine]-1'-yl]piperidine-1-carboxylate
CID 157352592
2-[3-Amino-6-(2,4-difluorophenyl)-2-pyridinyl]-1-[3-(5-methyl-1,3-thiazol-2-yl)pyrrolidin-1-yl]ethanone;2-[3-amino-6-(4-fluorophenyl)-2-pyridinyl]-1-[3-(5-fluoropyrimidin-2-yl)pyrrolidin-1-yl]ethanone;2-[3-amino-6-(2-methylphenyl)-2-pyridinyl]-1-[3-(5-fluoropyrimidin-2-yl)pyrrolidin-1-yl]ethanone
CID 157462247
1-[4-[2-(3,5-Ditert-butylphenyl)-1,3-thiazol-5-yl]piperidin-1-yl]-2-imidazo[4,5-c]pyridin-1-ylethanone;1-[4-[2-(3,5-ditert-butylphenyl)-1,3-thiazol-5-yl]piperidin-1-yl]-2-imidazo[4,5-c]pyridin-3-ylethanone
CID 157580314
8-(Dimethylamino)-3-(2-methylphenyl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-8-phenyl-3-(4-phenyl-1,3-thiazol-2-yl)-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-8-phenyl-3-(2-pyrrolo[2,3-b]pyridin-1-ylpyrimidin-5-yl)-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-8-phenyl-3-[2-(3,4,5-trifluorophenyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one
CID 157863434
11-Methyl-10,10a-dihydropurino[7,8-a]indole;11-propan-2-yl-10,10a-dihydropurino[7,8-a]indole;11-pyridin-2-yl-10,10a-dihydropurino[7,8-a]indole;11-thiophen-2-yl-10,10a-dihydropurino[7,8-a]indole
CID 158500932
1-[4-[2-(3,5-Ditert-butylphenyl)-1,3-thiazol-5-yl]piperidin-1-yl]-2-imidazo[4,5-b]pyridin-1-ylethanone;1-[4-[2-(3,5-ditert-butylphenyl)-1,3-thiazol-5-yl]piperidin-1-yl]-2-imidazo[4,5-b]pyridin-3-ylethanone
CID 158503728
1-[1'-[1-(5,6-dimethylpyrazin-2-yl)piperidin-4-yl]spiro[2H-indole-3,4'-piperidine]-1-yl]ethanone;ethyl 4-(1-acetyl-7-thiophen-3-ylspiro[2H-indole-3,4'-piperidine]-1'-yl)piperidine-1-carboxylate;5-fluoro-N,N-dimethyl-1'-[1-(1,3-thiazol-2-yl)piperidin-4-yl]spiro[2H-indole-3,4'-piperidine]-1-carboxamide
CID 158616715

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-N,N-dimethyl-1'-(1-pyridin-2-ylpiperidin-4-yl)spiro[2H-indole-3,4'-piperidine]-1-carboxamide;5-fluoro-N,N-dimethyl-1'-(1-pyrimidin-5-ylpiperidin-4-yl)spiro[2H-indole-3,4'-piperidine]-1-carboxamide;5-fluoro-N,N-dimethyl-1'-[1-(1,3-thiazol-2-yl)piperidin-4-yl]spiro[2H-indole-3,4'-piperidine]-1-carboxamide?
The IUPAC name of 5-fluoro-N,N-dimethyl-1'-(1-pyridin-2-ylpiperidin-4-yl)spiro[2H-indole-3,4'-piperidine]-1-carboxamide;5-fluoro-N,N-dimethyl-1'-(1-pyrimidin-5-ylpiperidin-4-yl)spiro[2H-indole-3,4'-piperidine]-1-carboxamide;5-fluoro-N,N-dimethyl-1'-[1-(1,3-thiazol-2-yl)piperidin-4-yl]spiro[2H-indole-3,4'-piperidine]-1-carboxamide (CID 157398266) is 5-fluoro-N,N-dimethyl-1'-(1-pyridin-2-ylpiperidin-4-yl)spiro[2H-indole-3,4'-piperidine]-1-carboxamide;5-fluoro-N,N-dimethyl-1'-(1-pyrimidin-5-ylpiperidin-4-yl)spiro[2H-indole-3,4'-piperidine]-1-carboxamide;5-fluoro-N,N-dimethyl-1'-[1-(1,3-thiazol-2-yl)piperidin-4-yl]spiro[2H-indole-3,4'-piperidine]-1-carboxamide.
What is the SMILES notation for 5-fluoro-N,N-dimethyl-1'-(1-pyridin-2-ylpiperidin-4-yl)spiro[2H-indole-3,4'-piperidine]-1-carboxamide;5-fluoro-N,N-dimethyl-1'-(1-pyrimidin-5-ylpiperidin-4-yl)spiro[2H-indole-3,4'-piperidine]-1-carboxamide;5-fluoro-N,N-dimethyl-1'-[1-(1,3-thiazol-2-yl)piperidin-4-yl]spiro[2H-indole-3,4'-piperidine]-1-carboxamide?
The canonical SMILES for 5-fluoro-N,N-dimethyl-1'-(1-pyridin-2-ylpiperidin-4-yl)spiro[2H-indole-3,4'-piperidine]-1-carboxamide;5-fluoro-N,N-dimethyl-1'-(1-pyrimidin-5-ylpiperidin-4-yl)spiro[2H-indole-3,4'-piperidine]-1-carboxamide;5-fluoro-N,N-dimethyl-1'-[1-(1,3-thiazol-2-yl)piperidin-4-yl]spiro[2H-indole-3,4'-piperidine]-1-carboxamide is CN(C)C(=O)N1CC2(CCN(C3CCN(c4ccccn4)CC3)CC2)c2cc(F)ccc21.CN(C)C(=O)N1CC2(CCN(C3CCN(c4cncnc4)CC3)CC2)c2cc(F)ccc21.CN(C)C(=O)N1CC2(CCN(C3CCN(c4nccs4)CC3)CC2)c2cc(F)ccc21.
What is the InChIKey of 5-fluoro-N,N-dimethyl-1'-(1-pyridin-2-ylpiperidin-4-yl)spiro[2H-indole-3,4'-piperidine]-1-carboxamide;5-fluoro-N,N-dimethyl-1'-(1-pyrimidin-5-ylpiperidin-4-yl)spiro[2H-indole-3,4'-piperidine]-1-carboxamide;5-fluoro-N,N-dimethyl-1'-[1-(1,3-thiazol-2-yl)piperidin-4-yl]spiro[2H-indole-3,4'-piperidine]-1-carboxamide?
The InChIKey is BMVKXFRUMNXXBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H32FN5O.C24H31FN6O.C23H30FN5OS/c1-28(2)24(32)31-18-25(21-17-19(26)6-7-22(21)31)10-15-29(16-11-25)20-8-13-30(14-9-20)23-5-3-4-12-27-23;1-28(2)23(32)31-16-24(21-13-18(25)3-4-22(21)31)7-11-30(12-8-24)19-5-9-29(10-6-19)20-14-26-17-27-15-20;1-26(2)22(30)29-16-23(19-15-17(24)3-4-20(19)29)7-12-27(13-8-23)18-5-10-28(11-6-18)21-25-9-14-31-21/h3-7,12,17,20H,8-11,13-16,18H2,1-2H3;3-4,13-15,17,19H,5-12,16H2,1-2H3;3-4,9,14-15,18H,5-8,10-13,16H2,1-2H3.
What are the key properties of 5-fluoro-N,N-dimethyl-1'-(1-pyridin-2-ylpiperidin-4-yl)spiro[2H-indole-3,4'-piperidine]-1-carboxamide;5-fluoro-N,N-dimethyl-1'-(1-pyrimidin-5-ylpiperidin-4-yl)spiro[2H-indole-3,4'-piperidine]-1-carboxamide;5-fluoro-N,N-dimethyl-1'-[1-(1,3-thiazol-2-yl)piperidin-4-yl]spiro[2H-indole-3,4'-piperidine]-1-carboxamide?
5-fluoro-N,N-dimethyl-1'-(1-pyridin-2-ylpiperidin-4-yl)spiro[2H-indole-3,4'-piperidine]-1-carboxamide;5-fluoro-N,N-dimethyl-1'-(1-pyrimidin-5-ylpiperidin-4-yl)spiro[2H-indole-3,4'-piperidine]-1-carboxamide;5-fluoro-N,N-dimethyl-1'-[1-(1,3-thiazol-2-yl)piperidin-4-yl]spiro[2H-indole-3,4'-piperidine]-1-carboxamide has a molecular weight of 1319.71 g/mol, XLogP of 10.63, 6 rotatable bonds, 0 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-N,N-dimethyl-1'-(1-pyridin-2-ylpiperidin-4-yl)spiro[2H-indole-3,4'-piperidine]-1-carboxamide;5-fluoro-N,N-dimethyl-1'-(1-pyrimidin-5-ylpiperidin-4-yl)spiro[2H-indole-3,4'-piperidine]-1-carboxamide;5-fluoro-N,N-dimethyl-1'-[1-(1,3-thiazol-2-yl)piperidin-4-yl]spiro[2H-indole-3,4'-piperidine]-1-carboxamide is sourced from PubChem (CID 157398266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).