3-chloro-N-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyridine-2-carboxamide;3,5-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1H-imidazol-3-ium-4-carboxamide;1,3-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazole-4-carboxamide;2-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1,3-oxazole-4-carboxamide;1-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazole-3-carboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1-propan-2-ylpyrazole-4-carboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazine-2-carboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrimidine-5-carboxamide

C118H196ClN30O9+ — CID 159036811

IUPAC3-chloro-N-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyridine-2-carboxamide;3,5-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1H-imidazol-3-ium-4-carboxamide;1,3-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazole-4-carboxamide;2-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1,3-oxazole-4-carboxamide;1-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazole-3-carboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1-propan-2-ylpyrazole-4-carboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazine-2-carboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrimidine-5-carboxamide
SMILESCC(C)N1CCC(C)(N(C)C(=O)c2ncccc2Cl)CC1.CC(C)N1CCC(C)(NC(=O)c2ccn(C)n2)CC1.CC(C)N1CCC(C)(NC(=O)c2cnccn2)CC1.CC(C)N1CCC(C)(NC(=O)c2cncnc2)CC1.CC(C)N1CCC(C)(NC(=O)c2cnn(C(C)C)c2)CC1.Cc1[nH]c[n+](C)c1C(=O)NC1(C)CCN(C(C)C)CC1.Cc1nc(C(=O)NC2(C)CCN(C(C)C)CC2)co1.Cc1nn(C)cc1C(=O)NC1(C)CCN(C(C)C)CC1
InChIInChI=1S/C16H24ClN3O.C16H28N4O.2C15H26N4O.C14H24N4O.2C14H22N4O.C14H23N3O2/c1-12(2)20-10-7-16(3,8-11-20)19(4)15(21)14-13(17)6-5-9-18-14;1-12(2)19-8-6-16(5,7-9-19)18-15(21)14-10-17-20(11-14)13(3)4;1-11(2)19-8-6-15(4,7-9-19)17-14(20)13-12(3)16-10-18(13)5;1-11(2)19-8-6-15(4,7-9-19)16-14(20)13-10-18(5)17-12(13)3;1-11(2)18-9-6-14(3,7-10-18)15-13(19)12-5-8-17(4)16-12;1-11(2)18-8-4-14(3,5-9-18)17-13(19)12-10-15-6-7-16-12;1-11(2)18-6-4-14(3,5-7-18)17-13(19)12-8-15-10-16-9-12;1-10(2)17-7-5-14(4,6-8-17)16-13(18)12-9-19-11(3)15-12/h5-6,9,12H,7-8,10-11H2,1-4H3;10-13H,6-9H2,1-5H3,(H,18,21);10-11H,6-9H2,1-5H3,(H,17,20);10-11H,6-9H2,1-5H3,(H,16,20);5,8,11H,6-7,9-10H2,1-4H3,(H,15,19);6-7,10-11H,4-5,8-9H2,1-3H3,(H,17,19);8-11H,4-7H2,1-3H3,(H,17,19);9-10H,5-8H2,1-4H3,(H,16,18)/p+1
InChIKeyAIDAEKUWVNPWIH-UHFFFAOYSA-O
MW2214.52 g/mol
LogP14.72
Rot. Bonds25

About 3-chloro-N-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyridine-2-carboxamide;3,5-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1H-imidazol-3-ium-4-carboxamide;1,3-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazole-4-carboxamide;2-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1,3-oxazole-4-carboxamide;1-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazole-3-carboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1-propan-2-ylpyrazole-4-carboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazine-2-carboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrimidine-5-carboxamide

3-chloro-N-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyridine-2-carboxamide;3,5-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1H-imidazol-3-ium-4-carboxamide;1,3-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazole-4-carboxamide;2-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1,3-oxazole-4-carboxamide;1-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazole-3-carboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1-propan-2-ylpyrazole-4-carboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazine-2-carboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrimidine-5-carboxamide (PubChem CID 159036811) has the molecular formula C118H196ClN30O9+ and a molecular weight of 2214.52 g/mol. Its IUPAC name is 3-chloro-N-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyridine-2-carboxamide;3,5-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1H-imidazol-3-ium-4-carboxamide;1,3-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazole-4-carboxamide;2-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1,3-oxazole-4-carboxamide;1-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazole-3-carboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1-propan-2-ylpyrazole-4-carboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazine-2-carboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrimidine-5-carboxamide.

Molecular Properties

Compound Name3-chloro-N-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyridine-2-carboxamide;3,5-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1H-imidazol-3-ium-4-carboxamide;1,3-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazole-4-carboxamide;2-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1,3-oxazole-4-carboxamide;1-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazole-3-carboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1-propan-2-ylpyrazole-4-carboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazine-2-carboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrimidine-5-carboxamide
PubChem CID159036811
Molecular FormulaC118H196ClN30O9+
Molecular Weight2214.52 g/mol
Exact Mass2212.55
IUPAC Name3-chloro-N-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyridine-2-carboxamide;3,5-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1H-imidazol-3-ium-4-carboxamide;1,3-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazole-4-carboxamide;2-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1,3-oxazole-4-carboxamide;1-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazole-3-carboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1-propan-2-ylpyrazole-4-carboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazine-2-carboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrimidine-5-carboxamide
SMILESCC(C)N1CCC(C)(N(C)C(=O)c2ncccc2Cl)CC1.CC(C)N1CCC(C)(NC(=O)c2ccn(C)n2)CC1.CC(C)N1CCC(C)(NC(=O)c2cnccn2)CC1.CC(C)N1CCC(C)(NC(=O)c2cncnc2)CC1.CC(C)N1CCC(C)(NC(=O)c2cnn(C(C)C)c2)CC1.Cc1[nH]c[n+](C)c1C(=O)NC1(C)CCN(C(C)C)CC1.Cc1nc(C(=O)NC2(C)CCN(C(C)C)CC2)co1.Cc1nn(C)cc1C(=O)NC1(C)CCN(C(C)C)CC1
InChIInChI=1S/C16H24ClN3O.C16H28N4O.2C15H26N4O.C14H24N4O.2C14H22N4O.C14H23N3O2/c1-12(2)20-10-7-16(3,8-11-20)19(4)15(21)14-13(17)6-5-9-18-14;1-12(2)19-8-6-16(5,7-9-19)18-15(21)14-10-17-20(11-14)13(3)4;1-11(2)19-8-6-15(4,7-9-19)17-14(20)13-12(3)16-10-18(13)5;1-11(2)19-8-6-15(4,7-9-19)16-14(20)13-10-18(5)17-12(13)3;1-11(2)18-9-6-14(3,7-10-18)15-13(19)12-5-8-17(4)16-12;1-11(2)18-8-4-14(3,5-9-18)17-13(19)12-10-15-6-7-16-12;1-11(2)18-6-4-14(3,5-7-18)17-13(19)12-8-15-10-16-9-12;1-10(2)17-7-5-14(4,6-8-17)16-13(18)12-9-19-11(3)15-12/h5-6,9,12H,7-8,10-11H2,1-4H3;10-13H,6-9H2,1-5H3,(H,18,21);10-11H,6-9H2,1-5H3,(H,17,20);10-11H,6-9H2,1-5H3,(H,16,20);5,8,11H,6-7,9-10H2,1-4H3,(H,15,19);6-7,10-11H,4-5,8-9H2,1-3H3,(H,17,19);8-11H,4-7H2,1-3H3,(H,17,19);9-10H,5-8H2,1-4H3,(H,16,18)/p+1
InChIKeyAIDAEKUWVNPWIH-UHFFFAOYSA-O
XLogP14.72
TPSA413.54 Ų
H-Bond Donors8
H-Bond Acceptors29
Rotatable Bonds25
Heavy Atoms158
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002214.52
LogP ≤ 514.72
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1029

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

Analyze 3-chloro-N-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyridine-2-carboxamide;3,5-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1H-imidazol-3-ium-4-carboxamide;1,3-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazole-4-carboxamide;2-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1,3-oxazole-4-carboxamide;1-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazole-3-carboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1-propan-2-ylpyrazole-4-carboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazine-2-carboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrimidine-5-carboxamide with MolForge

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Launch Full Analysis

Related Compounds

2-cyclopropyl-N-[(3S,4S)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]-1,3-oxazole-4-carboxamide;5-cyclopropyl-N-[(3S,4R)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]-1H-pyrazole-3-carboxamide;6-cyclopropyl-N-[(3S,4S)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]pyridazine-4-carboxamide;6-cyclopropyl-N-[(3S,4R)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]pyridazine-4-carboxamide;4-cyclopropyl-N-[(3S,4R)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]pyrimidine-2-carboxamide;5-cyclopropyl-N-[(3S,4R)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]pyrimidine-2-carboxamide;6-cyclopropyl-N-[(3S,4R)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]pyrimidine-4-carboxamide
CID 157488419
N-(1-tert-butyl-3-methylpyrrolidin-3-yl)-3-fluoropyridine-2-carboxamide;3-chloro-N-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyridine-2-carboxamide;3,5-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)imidazole-4-carboxamide;1,3-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazole-4-carboxamide;2-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1,3-oxazole-4-carboxamide;1-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazole-3-carboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1-propan-2-ylpyrazole-4-carboxamide
CID 159780661
3-chloro-N-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyridine-2-carboxamide;3,5-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)imidazole-4-carboxamide;1,3-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazole-4-carboxamide;2-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1,3-oxazole-4-carboxamide;1-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazole-3-carboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1-propan-2-ylpyrazole-4-carboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazine-2-carboxamide
CID 159940565
3,5-diamino-6-chloro-N-[8-(cyclohexanecarbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1H-imidazole-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1,3-oxazole-4-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(piperidine-4-carbonyl)-1,8-diazaspiro[4.5]dec-1-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(pyridine-2-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(pyridine-4-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide
CID 160495266
3-chloro-N-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyridine-2-carboxamide;3,5-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)imidazole-4-carboxamide;1,3-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazole-4-carboxamide;2-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1,3-oxazole-4-carboxamide;1-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazole-3-carboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1-propan-2-ylpyrazole-4-carboxamide
CID 161525540
3-chloro-N-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyridine-2-carboxamide;3,5-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)imidazole-4-carboxamide;1,3-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazole-4-carboxamide;5-fluoro-2-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyridine-4-carboxamide;2-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1,3-oxazole-4-carboxamide;1-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazole-3-carboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazine-2-carboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrimidine-5-carboxamide
CID 161868622
N-(1-tert-butylpyrrolidin-3-yl)-3-fluoropyridine-2-carboxamide;3-chloro-N-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyridine-2-carboxamide;3,5-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)imidazole-4-carboxamide;1,3-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazole-4-carboxamide;2-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1,3-oxazole-4-carboxamide;1-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazole-3-carboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1-propan-2-ylpyrazole-4-carboxamide
CID 161876759
CID 167545127
CID 167545127

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyridine-2-carboxamide;3,5-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1H-imidazol-3-ium-4-carboxamide;1,3-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazole-4-carboxamide;2-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1,3-oxazole-4-carboxamide;1-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazole-3-carboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1-propan-2-ylpyrazole-4-carboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazine-2-carboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrimidine-5-carboxamide?
The IUPAC name of 3-chloro-N-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyridine-2-carboxamide;3,5-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1H-imidazol-3-ium-4-carboxamide;1,3-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazole-4-carboxamide;2-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1,3-oxazole-4-carboxamide;1-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazole-3-carboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1-propan-2-ylpyrazole-4-carboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazine-2-carboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrimidine-5-carboxamide (CID 159036811) is 3-chloro-N-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyridine-2-carboxamide;3,5-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1H-imidazol-3-ium-4-carboxamide;1,3-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazole-4-carboxamide;2-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1,3-oxazole-4-carboxamide;1-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazole-3-carboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1-propan-2-ylpyrazole-4-carboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazine-2-carboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrimidine-5-carboxamide.
What is the SMILES notation for 3-chloro-N-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyridine-2-carboxamide;3,5-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1H-imidazol-3-ium-4-carboxamide;1,3-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazole-4-carboxamide;2-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1,3-oxazole-4-carboxamide;1-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazole-3-carboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1-propan-2-ylpyrazole-4-carboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazine-2-carboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrimidine-5-carboxamide?
The canonical SMILES for 3-chloro-N-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyridine-2-carboxamide;3,5-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1H-imidazol-3-ium-4-carboxamide;1,3-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazole-4-carboxamide;2-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1,3-oxazole-4-carboxamide;1-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazole-3-carboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1-propan-2-ylpyrazole-4-carboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazine-2-carboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrimidine-5-carboxamide is CC(C)N1CCC(C)(N(C)C(=O)c2ncccc2Cl)CC1.CC(C)N1CCC(C)(NC(=O)c2ccn(C)n2)CC1.CC(C)N1CCC(C)(NC(=O)c2cnccn2)CC1.CC(C)N1CCC(C)(NC(=O)c2cncnc2)CC1.CC(C)N1CCC(C)(NC(=O)c2cnn(C(C)C)c2)CC1.Cc1[nH]c[n+](C)c1C(=O)NC1(C)CCN(C(C)C)CC1.Cc1nc(C(=O)NC2(C)CCN(C(C)C)CC2)co1.Cc1nn(C)cc1C(=O)NC1(C)CCN(C(C)C)CC1.
What is the InChIKey of 3-chloro-N-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyridine-2-carboxamide;3,5-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1H-imidazol-3-ium-4-carboxamide;1,3-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazole-4-carboxamide;2-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1,3-oxazole-4-carboxamide;1-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazole-3-carboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1-propan-2-ylpyrazole-4-carboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazine-2-carboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrimidine-5-carboxamide?
The InChIKey is AIDAEKUWVNPWIH-UHFFFAOYSA-O. The full InChI is InChI=1S/C16H24ClN3O.C16H28N4O.2C15H26N4O.C14H24N4O.2C14H22N4O.C14H23N3O2/c1-12(2)20-10-7-16(3,8-11-20)19(4)15(21)14-13(17)6-5-9-18-14;1-12(2)19-8-6-16(5,7-9-19)18-15(21)14-10-17-20(11-14)13(3)4;1-11(2)19-8-6-15(4,7-9-19)17-14(20)13-12(3)16-10-18(13)5;1-11(2)19-8-6-15(4,7-9-19)16-14(20)13-10-18(5)17-12(13)3;1-11(2)18-9-6-14(3,7-10-18)15-13(19)12-5-8-17(4)16-12;1-11(2)18-8-4-14(3,5-9-18)17-13(19)12-10-15-6-7-16-12;1-11(2)18-6-4-14(3,5-7-18)17-13(19)12-8-15-10-16-9-12;1-10(2)17-7-5-14(4,6-8-17)16-13(18)12-9-19-11(3)15-12/h5-6,9,12H,7-8,10-11H2,1-4H3;10-13H,6-9H2,1-5H3,(H,18,21);10-11H,6-9H2,1-5H3,(H,17,20);10-11H,6-9H2,1-5H3,(H,16,20);5,8,11H,6-7,9-10H2,1-4H3,(H,15,19);6-7,10-11H,4-5,8-9H2,1-3H3,(H,17,19);8-11H,4-7H2,1-3H3,(H,17,19);9-10H,5-8H2,1-4H3,(H,16,18)/p+1.
What are the key properties of 3-chloro-N-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyridine-2-carboxamide;3,5-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1H-imidazol-3-ium-4-carboxamide;1,3-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazole-4-carboxamide;2-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1,3-oxazole-4-carboxamide;1-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazole-3-carboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1-propan-2-ylpyrazole-4-carboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazine-2-carboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrimidine-5-carboxamide?
3-chloro-N-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyridine-2-carboxamide;3,5-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1H-imidazol-3-ium-4-carboxamide;1,3-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazole-4-carboxamide;2-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1,3-oxazole-4-carboxamide;1-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazole-3-carboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1-propan-2-ylpyrazole-4-carboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazine-2-carboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrimidine-5-carboxamide has a molecular weight of 2214.52 g/mol, XLogP of 14.72, 25 rotatable bonds, 8 hydrogen bond donors, and 29 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyridine-2-carboxamide;3,5-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1H-imidazol-3-ium-4-carboxamide;1,3-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazole-4-carboxamide;2-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1,3-oxazole-4-carboxamide;1-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazole-3-carboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1-propan-2-ylpyrazole-4-carboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazine-2-carboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrimidine-5-carboxamide is sourced from PubChem (CID 159036811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).