2-tert-butyl-N-(6-methylidene-2-oxopiperidin-3-yl)-1,3-oxazole-5-carboxamide;5-tert-butyl-N-(6-methylidene-2-oxopiperidin-3-yl)pyridine-2-carboxamide;3-(5-tert-butyl-3-methyl-2-methylidenebenzimidazol-1-yl)piperidine-2,6-dione;3-(6-tert-butyl-3-methyl-2-methylidenebenzimidazol-1-yl)piperidine-2,6-dione;3-[(6-tert-butyl-3-pyridinyl)methyl]-6-methylidenepiperidin-2-one

C82H108N14O10 — CID 167694421

IUPAC2-tert-butyl-N-(6-methylidene-2-oxopiperidin-3-yl)-1,3-oxazole-5-carboxamide;5-tert-butyl-N-(6-methylidene-2-oxopiperidin-3-yl)pyridine-2-carboxamide;3-(5-tert-butyl-3-methyl-2-methylidenebenzimidazol-1-yl)piperidine-2,6-dione;3-(6-tert-butyl-3-methyl-2-methylidenebenzimidazol-1-yl)piperidine-2,6-dione;3-[(6-tert-butyl-3-pyridinyl)methyl]-6-methylidenepiperidin-2-one
SMILESC=C1CCC(Cc2ccc(C(C)(C)C)nc2)C(=O)N1.C=C1CCC(NC(=O)c2ccc(C(C)(C)C)cn2)C(=O)N1.C=C1CCC(NC(=O)c2cnc(C(C)(C)C)o2)C(=O)N1.C=C1N(C)c2cc(C(C)(C)C)ccc2N1C1CCC(=O)NC1=O.C=C1N(C)c2ccc(C(C)(C)C)cc2N1C1CCC(=O)NC1=O
InChIInChI=1S/2C18H23N3O2.C16H21N3O2.C16H22N2O.C14H19N3O3/c1-11-20(5)15-10-12(18(2,3)4)6-7-13(15)21(11)14-8-9-16(22)19-17(14)23;1-11-20(5)13-7-6-12(18(2,3)4)10-15(13)21(11)14-8-9-16(22)19-17(14)23;1-10-5-7-13(15(21)18-10)19-14(20)12-8-6-11(9-17-12)16(2,3)4;1-11-5-7-13(15(19)18-11)9-12-6-8-14(17-10-12)16(2,3)4;1-8-5-6-9(11(18)16-8)17-12(19)10-7-15-13(20-10)14(2,3)4/h2*6-7,10,14H,1,8-9H2,2-5H3,(H,19,22,23);6,8-9,13H,1,5,7H2,2-4H3,(H,18,21)(H,19,20);6,8,10,13H,1,5,7,9H2,2-4H3,(H,18,19);7,9H,1,5-6H2,2-4H3,(H,16,18)(H,17,19)
InChIKeyXKYROOROGQSGGT-UHFFFAOYSA-N
MW1449.85 g/mol
LogP11.39
Rot. Bonds8

About 2-tert-butyl-N-(6-methylidene-2-oxopiperidin-3-yl)-1,3-oxazole-5-carboxamide;5-tert-butyl-N-(6-methylidene-2-oxopiperidin-3-yl)pyridine-2-carboxamide;3-(5-tert-butyl-3-methyl-2-methylidenebenzimidazol-1-yl)piperidine-2,6-dione;3-(6-tert-butyl-3-methyl-2-methylidenebenzimidazol-1-yl)piperidine-2,6-dione;3-[(6-tert-butyl-3-pyridinyl)methyl]-6-methylidenepiperidin-2-one

2-tert-butyl-N-(6-methylidene-2-oxopiperidin-3-yl)-1,3-oxazole-5-carboxamide;5-tert-butyl-N-(6-methylidene-2-oxopiperidin-3-yl)pyridine-2-carboxamide;3-(5-tert-butyl-3-methyl-2-methylidenebenzimidazol-1-yl)piperidine-2,6-dione;3-(6-tert-butyl-3-methyl-2-methylidenebenzimidazol-1-yl)piperidine-2,6-dione;3-[(6-tert-butyl-3-pyridinyl)methyl]-6-methylidenepiperidin-2-one (PubChem CID 167694421) has the molecular formula C82H108N14O10 and a molecular weight of 1449.85 g/mol. Its IUPAC name is 2-tert-butyl-N-(6-methylidene-2-oxopiperidin-3-yl)-1,3-oxazole-5-carboxamide;5-tert-butyl-N-(6-methylidene-2-oxopiperidin-3-yl)pyridine-2-carboxamide;3-(5-tert-butyl-3-methyl-2-methylidenebenzimidazol-1-yl)piperidine-2,6-dione;3-(6-tert-butyl-3-methyl-2-methylidenebenzimidazol-1-yl)piperidine-2,6-dione;3-[(6-tert-butyl-3-pyridinyl)methyl]-6-methylidenepiperidin-2-one.

Molecular Properties

Compound Name2-tert-butyl-N-(6-methylidene-2-oxopiperidin-3-yl)-1,3-oxazole-5-carboxamide;5-tert-butyl-N-(6-methylidene-2-oxopiperidin-3-yl)pyridine-2-carboxamide;3-(5-tert-butyl-3-methyl-2-methylidenebenzimidazol-1-yl)piperidine-2,6-dione;3-(6-tert-butyl-3-methyl-2-methylidenebenzimidazol-1-yl)piperidine-2,6-dione;3-[(6-tert-butyl-3-pyridinyl)methyl]-6-methylidenepiperidin-2-one
PubChem CID167694421
Molecular FormulaC82H108N14O10
Molecular Weight1449.85 g/mol
Exact Mass1448.84
IUPAC Name2-tert-butyl-N-(6-methylidene-2-oxopiperidin-3-yl)-1,3-oxazole-5-carboxamide;5-tert-butyl-N-(6-methylidene-2-oxopiperidin-3-yl)pyridine-2-carboxamide;3-(5-tert-butyl-3-methyl-2-methylidenebenzimidazol-1-yl)piperidine-2,6-dione;3-(6-tert-butyl-3-methyl-2-methylidenebenzimidazol-1-yl)piperidine-2,6-dione;3-[(6-tert-butyl-3-pyridinyl)methyl]-6-methylidenepiperidin-2-one
SMILESC=C1CCC(Cc2ccc(C(C)(C)C)nc2)C(=O)N1.C=C1CCC(NC(=O)c2ccc(C(C)(C)C)cn2)C(=O)N1.C=C1CCC(NC(=O)c2cnc(C(C)(C)C)o2)C(=O)N1.C=C1N(C)c2cc(C(C)(C)C)ccc2N1C1CCC(=O)NC1=O.C=C1N(C)c2ccc(C(C)(C)C)cc2N1C1CCC(=O)NC1=O
InChIInChI=1S/2C18H23N3O2.C16H21N3O2.C16H22N2O.C14H19N3O3/c1-11-20(5)15-10-12(18(2,3)4)6-7-13(15)21(11)14-8-9-16(22)19-17(14)23;1-11-20(5)13-7-6-12(18(2,3)4)10-15(13)21(11)14-8-9-16(22)19-17(14)23;1-10-5-7-13(15(21)18-10)19-14(20)12-8-6-11(9-17-12)16(2,3)4;1-11-5-7-13(15(19)18-11)9-12-6-8-14(17-10-12)16(2,3)4;1-8-5-6-9(11(18)16-8)17-12(19)10-7-15-13(20-10)14(2,3)4/h2*6-7,10,14H,1,8-9H2,2-5H3,(H,19,22,23);6,8-9,13H,1,5,7H2,2-4H3,(H,18,21)(H,19,20);6,8,10,13H,1,5,7,9H2,2-4H3,(H,18,19);7,9H,1,5-6H2,2-4H3,(H,16,18)(H,17,19)
InChIKeyXKYROOROGQSGGT-UHFFFAOYSA-N
XLogP11.39
TPSA302.61 Ų
H-Bond Donors7
H-Bond Acceptors17
Rotatable Bonds8
Heavy Atoms106
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001449.85
LogP ≤ 511.39
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1017

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phthalimide', 'substructure': 'N/A'}

Analyze 2-tert-butyl-N-(6-methylidene-2-oxopiperidin-3-yl)-1,3-oxazole-5-carboxamide;5-tert-butyl-N-(6-methylidene-2-oxopiperidin-3-yl)pyridine-2-carboxamide;3-(5-tert-butyl-3-methyl-2-methylidenebenzimidazol-1-yl)piperidine-2,6-dione;3-(6-tert-butyl-3-methyl-2-methylidenebenzimidazol-1-yl)piperidine-2,6-dione;3-[(6-tert-butyl-3-pyridinyl)methyl]-6-methylidenepiperidin-2-one with MolForge

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Related Compounds

bis(5-tert-butyl-N-(6-methylidene-2-oxopiperidin-3-yl)pyridine-2-carboxamide);3-[(6-tert-butyl-3-pyridinyl)amino]-6-methylidenepiperidin-2-one
CID 167577573
3-[(2-tert-butyl-4-pyridinyl)methyl]-6-methylidenepiperidin-2-one
CID 167616983
5-tert-butyl-N-(2-oxopiperidin-3-yl)pyridine-2-carboxamide
CID 170175526
N-[(3R)-2,6-dioxopiperidin-3-yl]pyridine-2-carboxamide
CID 175992021
N-(2,6-dioxopiperidin-3-yl)-5-(1-propan-2-ylpiperidin-4-yl)pyridine-2-carboxamide
CID 171786638
3-[6-[4-(5-tert-butyl-2-pyridinyl)-4,4-difluoro-3-oxobutyl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione
CID 146747018
N-(2,6-dioxopiperidin-3-yl)-8-oxa-1,6,12-triazatricyclo[8.4.0.02,7]tetradeca-2(7),3,5-triene-5-carboxamide
CID 170727346
2-(2,6-dioxopiperidin-3-yl)-5-[3-(5-methylsulfonyl-2-pyridinyl)-3-oxopropyl]isoindole-1,3-dione
CID 158125813
4-tert-butyl-N-(2,6-dioxopiperidin-3-yl)-2-methoxybenzamide
CID 156551077
N-(2,6-dioxopiperidin-3-yl)-4-propylbenzamide
CID 168945690
2-tert-butyl-N-(2,6-dioxopiperidin-3-yl)-1,3-thiazole-5-carboxamide
CID 167377021
N-(2,6-dioxopiperidin-3-yl)-4-piperazin-1-ylpyridine-2-carboxamide
CID 172609767

Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-N-(6-methylidene-2-oxopiperidin-3-yl)-1,3-oxazole-5-carboxamide;5-tert-butyl-N-(6-methylidene-2-oxopiperidin-3-yl)pyridine-2-carboxamide;3-(5-tert-butyl-3-methyl-2-methylidenebenzimidazol-1-yl)piperidine-2,6-dione;3-(6-tert-butyl-3-methyl-2-methylidenebenzimidazol-1-yl)piperidine-2,6-dione;3-[(6-tert-butyl-3-pyridinyl)methyl]-6-methylidenepiperidin-2-one?
The IUPAC name of 2-tert-butyl-N-(6-methylidene-2-oxopiperidin-3-yl)-1,3-oxazole-5-carboxamide;5-tert-butyl-N-(6-methylidene-2-oxopiperidin-3-yl)pyridine-2-carboxamide;3-(5-tert-butyl-3-methyl-2-methylidenebenzimidazol-1-yl)piperidine-2,6-dione;3-(6-tert-butyl-3-methyl-2-methylidenebenzimidazol-1-yl)piperidine-2,6-dione;3-[(6-tert-butyl-3-pyridinyl)methyl]-6-methylidenepiperidin-2-one (CID 167694421) is 2-tert-butyl-N-(6-methylidene-2-oxopiperidin-3-yl)-1,3-oxazole-5-carboxamide;5-tert-butyl-N-(6-methylidene-2-oxopiperidin-3-yl)pyridine-2-carboxamide;3-(5-tert-butyl-3-methyl-2-methylidenebenzimidazol-1-yl)piperidine-2,6-dione;3-(6-tert-butyl-3-methyl-2-methylidenebenzimidazol-1-yl)piperidine-2,6-dione;3-[(6-tert-butyl-3-pyridinyl)methyl]-6-methylidenepiperidin-2-one.
What is the SMILES notation for 2-tert-butyl-N-(6-methylidene-2-oxopiperidin-3-yl)-1,3-oxazole-5-carboxamide;5-tert-butyl-N-(6-methylidene-2-oxopiperidin-3-yl)pyridine-2-carboxamide;3-(5-tert-butyl-3-methyl-2-methylidenebenzimidazol-1-yl)piperidine-2,6-dione;3-(6-tert-butyl-3-methyl-2-methylidenebenzimidazol-1-yl)piperidine-2,6-dione;3-[(6-tert-butyl-3-pyridinyl)methyl]-6-methylidenepiperidin-2-one?
The canonical SMILES for 2-tert-butyl-N-(6-methylidene-2-oxopiperidin-3-yl)-1,3-oxazole-5-carboxamide;5-tert-butyl-N-(6-methylidene-2-oxopiperidin-3-yl)pyridine-2-carboxamide;3-(5-tert-butyl-3-methyl-2-methylidenebenzimidazol-1-yl)piperidine-2,6-dione;3-(6-tert-butyl-3-methyl-2-methylidenebenzimidazol-1-yl)piperidine-2,6-dione;3-[(6-tert-butyl-3-pyridinyl)methyl]-6-methylidenepiperidin-2-one is C=C1CCC(Cc2ccc(C(C)(C)C)nc2)C(=O)N1.C=C1CCC(NC(=O)c2ccc(C(C)(C)C)cn2)C(=O)N1.C=C1CCC(NC(=O)c2cnc(C(C)(C)C)o2)C(=O)N1.C=C1N(C)c2cc(C(C)(C)C)ccc2N1C1CCC(=O)NC1=O.C=C1N(C)c2ccc(C(C)(C)C)cc2N1C1CCC(=O)NC1=O.
What is the InChIKey of 2-tert-butyl-N-(6-methylidene-2-oxopiperidin-3-yl)-1,3-oxazole-5-carboxamide;5-tert-butyl-N-(6-methylidene-2-oxopiperidin-3-yl)pyridine-2-carboxamide;3-(5-tert-butyl-3-methyl-2-methylidenebenzimidazol-1-yl)piperidine-2,6-dione;3-(6-tert-butyl-3-methyl-2-methylidenebenzimidazol-1-yl)piperidine-2,6-dione;3-[(6-tert-butyl-3-pyridinyl)methyl]-6-methylidenepiperidin-2-one?
The InChIKey is XKYROOROGQSGGT-UHFFFAOYSA-N. The full InChI is InChI=1S/2C18H23N3O2.C16H21N3O2.C16H22N2O.C14H19N3O3/c1-11-20(5)15-10-12(18(2,3)4)6-7-13(15)21(11)14-8-9-16(22)19-17(14)23;1-11-20(5)13-7-6-12(18(2,3)4)10-15(13)21(11)14-8-9-16(22)19-17(14)23;1-10-5-7-13(15(21)18-10)19-14(20)12-8-6-11(9-17-12)16(2,3)4;1-11-5-7-13(15(19)18-11)9-12-6-8-14(17-10-12)16(2,3)4;1-8-5-6-9(11(18)16-8)17-12(19)10-7-15-13(20-10)14(2,3)4/h2*6-7,10,14H,1,8-9H2,2-5H3,(H,19,22,23);6,8-9,13H,1,5,7H2,2-4H3,(H,18,21)(H,19,20);6,8,10,13H,1,5,7,9H2,2-4H3,(H,18,19);7,9H,1,5-6H2,2-4H3,(H,16,18)(H,17,19).
What are the key properties of 2-tert-butyl-N-(6-methylidene-2-oxopiperidin-3-yl)-1,3-oxazole-5-carboxamide;5-tert-butyl-N-(6-methylidene-2-oxopiperidin-3-yl)pyridine-2-carboxamide;3-(5-tert-butyl-3-methyl-2-methylidenebenzimidazol-1-yl)piperidine-2,6-dione;3-(6-tert-butyl-3-methyl-2-methylidenebenzimidazol-1-yl)piperidine-2,6-dione;3-[(6-tert-butyl-3-pyridinyl)methyl]-6-methylidenepiperidin-2-one?
2-tert-butyl-N-(6-methylidene-2-oxopiperidin-3-yl)-1,3-oxazole-5-carboxamide;5-tert-butyl-N-(6-methylidene-2-oxopiperidin-3-yl)pyridine-2-carboxamide;3-(5-tert-butyl-3-methyl-2-methylidenebenzimidazol-1-yl)piperidine-2,6-dione;3-(6-tert-butyl-3-methyl-2-methylidenebenzimidazol-1-yl)piperidine-2,6-dione;3-[(6-tert-butyl-3-pyridinyl)methyl]-6-methylidenepiperidin-2-one has a molecular weight of 1449.85 g/mol, XLogP of 11.39, 8 rotatable bonds, 7 hydrogen bond donors, and 17 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-N-(6-methylidene-2-oxopiperidin-3-yl)-1,3-oxazole-5-carboxamide;5-tert-butyl-N-(6-methylidene-2-oxopiperidin-3-yl)pyridine-2-carboxamide;3-(5-tert-butyl-3-methyl-2-methylidenebenzimidazol-1-yl)piperidine-2,6-dione;3-(6-tert-butyl-3-methyl-2-methylidenebenzimidazol-1-yl)piperidine-2,6-dione;3-[(6-tert-butyl-3-pyridinyl)methyl]-6-methylidenepiperidin-2-one is sourced from PubChem (CID 167694421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).