1-[1-[(4-anilinophenyl)methyl]-4-(cyanomethyl)piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[1-[(4-benzylphenyl)methyl]-4-(cyanomethyl)piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[4-(cyanomethyl)-1-[(4-phenoxyphenyl)methyl]piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[4-(cyanomethyl)-1-[(6-phenoxy-3-pyridinyl)methyl]piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide

C112H122N26O10 — CID 158948922

IUPAC1-[1-[(4-anilinophenyl)methyl]-4-(cyanomethyl)piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[1-[(4-benzylphenyl)methyl]-4-(cyanomethyl)piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[4-(cyanomethyl)-1-[(4-phenoxyphenyl)methyl]piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[4-(cyanomethyl)-1-[(6-phenoxy-3-pyridinyl)methyl]piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide
SMILESN#CCC1(n2cc(C(N)=O)c(NC(=O)C3CC3)n2)CCN(Cc2ccc(Cc3ccccc3)cc2)CC1.N#CCC1(n2cc(C(N)=O)c(NC(=O)C3CC3)n2)CCN(Cc2ccc(Nc3ccccc3)cc2)CC1.N#CCC1(n2cc(C(N)=O)c(NC(=O)C3CC3)n2)CCN(Cc2ccc(Oc3ccccc3)cc2)CC1.N#CCC1(n2cc(C(N)=O)c(NC(=O)C3CC3)n2)CCN(Cc2ccc(Oc3ccccc3)nc2)CC1
InChIInChI=1S/C29H32N6O2.C28H31N7O2.C28H30N6O3.C27H29N7O3/c30-15-12-29(35-20-25(26(31)36)27(33-35)32-28(37)24-10-11-24)13-16-34(17-14-29)19-23-8-6-22(7-9-23)18-21-4-2-1-3-5-21;29-15-12-28(35-19-24(25(30)36)26(33-35)32-27(37)21-8-9-21)13-16-34(17-14-28)18-20-6-10-23(11-7-20)31-22-4-2-1-3-5-22;29-15-12-28(34-19-24(25(30)35)26(32-34)31-27(36)21-8-9-21)13-16-33(17-14-28)18-20-6-10-23(11-7-20)37-22-4-2-1-3-5-22;28-13-10-27(34-18-22(24(29)35)25(32-34)31-26(36)20-7-8-20)11-14-33(15-12-27)17-19-6-9-23(30-16-19)37-21-4-2-1-3-5-21/h1-9,20,24H,10-14,16-19H2,(H2,31,36)(H,32,33,37);1-7,10-11,19,21,31H,8-9,12-14,16-18H2,(H2,30,36)(H,32,33,37);1-7,10-11,19,21H,8-9,12-14,16-18H2,(H2,30,35)(H,31,32,36);1-6,9,16,18,20H,7-8,10-12,14-15,17H2,(H2,29,35)(H,31,32,36)
InChIKeyJLEDGYZIQWEMDH-UHFFFAOYSA-N
MW1992.38 g/mol
LogP15.26
Rot. Bonds36

About 1-[1-[(4-anilinophenyl)methyl]-4-(cyanomethyl)piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[1-[(4-benzylphenyl)methyl]-4-(cyanomethyl)piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[4-(cyanomethyl)-1-[(4-phenoxyphenyl)methyl]piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[4-(cyanomethyl)-1-[(6-phenoxy-3-pyridinyl)methyl]piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide

1-[1-[(4-anilinophenyl)methyl]-4-(cyanomethyl)piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[1-[(4-benzylphenyl)methyl]-4-(cyanomethyl)piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[4-(cyanomethyl)-1-[(4-phenoxyphenyl)methyl]piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[4-(cyanomethyl)-1-[(6-phenoxy-3-pyridinyl)methyl]piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide (PubChem CID 158948922) has the molecular formula C112H122N26O10 and a molecular weight of 1992.38 g/mol. Its IUPAC name is 1-[1-[(4-anilinophenyl)methyl]-4-(cyanomethyl)piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[1-[(4-benzylphenyl)methyl]-4-(cyanomethyl)piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[4-(cyanomethyl)-1-[(4-phenoxyphenyl)methyl]piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[4-(cyanomethyl)-1-[(6-phenoxy-3-pyridinyl)methyl]piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide.

Molecular Properties

Compound Name1-[1-[(4-anilinophenyl)methyl]-4-(cyanomethyl)piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[1-[(4-benzylphenyl)methyl]-4-(cyanomethyl)piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[4-(cyanomethyl)-1-[(4-phenoxyphenyl)methyl]piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[4-(cyanomethyl)-1-[(6-phenoxy-3-pyridinyl)methyl]piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide
PubChem CID158948922
Molecular FormulaC112H122N26O10
Molecular Weight1992.38 g/mol
Exact Mass1990.98
IUPAC Name1-[1-[(4-anilinophenyl)methyl]-4-(cyanomethyl)piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[1-[(4-benzylphenyl)methyl]-4-(cyanomethyl)piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[4-(cyanomethyl)-1-[(4-phenoxyphenyl)methyl]piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[4-(cyanomethyl)-1-[(6-phenoxy-3-pyridinyl)methyl]piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide
SMILESN#CCC1(n2cc(C(N)=O)c(NC(=O)C3CC3)n2)CCN(Cc2ccc(Cc3ccccc3)cc2)CC1.N#CCC1(n2cc(C(N)=O)c(NC(=O)C3CC3)n2)CCN(Cc2ccc(Nc3ccccc3)cc2)CC1.N#CCC1(n2cc(C(N)=O)c(NC(=O)C3CC3)n2)CCN(Cc2ccc(Oc3ccccc3)cc2)CC1.N#CCC1(n2cc(C(N)=O)c(NC(=O)C3CC3)n2)CCN(Cc2ccc(Oc3ccccc3)nc2)CC1
InChIInChI=1S/C29H32N6O2.C28H31N7O2.C28H30N6O3.C27H29N7O3/c30-15-12-29(35-20-25(26(31)36)27(33-35)32-28(37)24-10-11-24)13-16-34(17-14-29)19-23-8-6-22(7-9-23)18-21-4-2-1-3-5-21;29-15-12-28(35-19-24(25(30)36)26(33-35)32-27(37)21-8-9-21)13-16-34(17-14-28)18-20-6-10-23(11-7-20)31-22-4-2-1-3-5-22;29-15-12-28(34-19-24(25(30)35)26(32-34)31-27(36)21-8-9-21)13-16-33(17-14-28)18-20-6-10-23(11-7-20)37-22-4-2-1-3-5-22;28-13-10-27(34-18-22(24(29)35)25(32-34)31-26(36)20-7-8-20)11-14-33(15-12-27)17-19-6-9-23(30-16-19)37-21-4-2-1-3-5-21/h1-9,20,24H,10-14,16-19H2,(H2,31,36)(H,32,33,37);1-7,10-11,19,21,31H,8-9,12-14,16-18H2,(H2,30,36)(H,32,33,37);1-7,10-11,19,21H,8-9,12-14,16-18H2,(H2,30,35)(H,31,32,36);1-6,9,16,18,20H,7-8,10-12,14-15,17H2,(H2,29,35)(H,31,32,36)
InChIKeyJLEDGYZIQWEMDH-UHFFFAOYSA-N
XLogP15.26
TPSA511.54 Ų
H-Bond Donors9
H-Bond Acceptors28
Rotatable Bonds36
Heavy Atoms148
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001992.38
LogP ≤ 515.26
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1028

Analyze 1-[1-[(4-anilinophenyl)methyl]-4-(cyanomethyl)piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[1-[(4-benzylphenyl)methyl]-4-(cyanomethyl)piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[4-(cyanomethyl)-1-[(4-phenoxyphenyl)methyl]piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[4-(cyanomethyl)-1-[(6-phenoxy-3-pyridinyl)methyl]piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide with MolForge

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Related Compounds

1-[4-(Cyanomethyl)-1-[(5-phenoxy-2-pyridinyl)methyl]piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[1-(cyanomethyl)-4-[6-(2,2,2-trifluoroethyl)-3,6-diazabicyclo[3.1.1]heptan-3-yl]cyclohexyl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[1-(cyanomethyl)-4-[4-(2,2,2-trifluoroethyl)piperidin-1-yl]cyclohexyl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[1-(cyanomethyl)-4-[4-(trifluoromethyl)piperidin-1-yl]cyclohexyl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide
CID 160124337
1-[1-[(3-Anilinophenyl)methyl]-4-(cyanomethyl)piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[4-(cyanomethyl)-1-[(5-phenoxy-2-pyridinyl)methyl]piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[1-(cyanomethyl)-4-[6-(2,2,2-trifluoroethyl)-3,6-diazabicyclo[3.1.1]heptan-3-yl]cyclohexyl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[1-(cyanomethyl)-4-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]cyclohexyl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[1-(cyanomethyl)-4-[4-(trifluoromethyl)piperidin-1-yl]cyclohexyl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide
CID 160761521
1-[4-(Cyanomethyl)-1-[(5-phenoxy-2-pyridinyl)methyl]piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[1-(cyanomethyl)-4-[6-(2,2,2-trifluoroethyl)-3,6-diazabicyclo[3.1.1]heptan-3-yl]cyclohexyl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[1-(cyanomethyl)-4-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]cyclohexyl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[1-(cyanomethyl)-4-[4-(trifluoromethyl)piperidin-1-yl]cyclohexyl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide
CID 161620754
N-[4-[4-[(6-cyano-3-pyridinyl)methoxy]phenyl]pyrazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide;4-[2-(cyclopropanecarbonylamino)pyrazolo[1,5-a]pyridin-4-yl]-N-(2-phenoxyethyl)benzamide;N-[4-[4-(pyridin-3-ylmethoxy)phenyl]pyrazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide
CID 89158231
N-[4-[4-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)methyl]phenyl]phenyl]acetamide;1-[3-[[4-(1,4-dimethylpyrazol-5-yl)phenyl]methyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[[4-[1-(2-methylpropyl)pyrazol-4-yl]phenyl]methyl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[[4-(2-methyl-3-pyridinyl)phenyl]methyl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[[4-(6-methyl-3-pyridinyl)phenyl]methyl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[4-(2-propan-2-yloxy-3-pyridinyl)anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone
CID 159420155
1-[1-Benzyl-4-(isocyanomethyl)piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;3-(cyclopropanecarbonylamino)-1-[4-(isocyanomethyl)-1-[(2-methoxyphenyl)methyl]piperidin-4-yl]pyrazole-4-carboxamide;3-(cyclopropanecarbonylamino)-1-[4-(isocyanomethyl)-1-[(3-methoxyphenyl)methyl]piperidin-4-yl]pyrazole-4-carboxamide;3-(cyclopropanecarbonylamino)-1-[4-(isocyanomethyl)-1-[(4-methoxyphenyl)methyl]piperidin-4-yl]pyrazole-4-carboxamide;3-(cyclopropanecarbonylamino)-1-[4-(isocyanomethyl)-1-[(4-piperidin-1-ylphenyl)methyl]piperidin-4-yl]pyrazole-4-carboxamide
CID 159806445
1-[1-[(3-Anilinophenyl)methyl]-4-(cyanomethyl)piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[1-(cyanomethyl)-4-(3-hydroxy-3-phenylazetidin-1-yl)cyclohexyl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[4-(cyanomethyl)-1-[(5-phenoxy-2-pyridinyl)methyl]piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;bis(1-[1-(cyanomethyl)-4-(3-phenylazetidin-1-yl)cyclohexyl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide)
CID 160404351
N-[4-[4-[(6-cyano-3-pyridinyl)methoxy]phenyl]pyrazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide;N-[4-[4-(pyridin-3-ylmethoxy)phenyl]pyrazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide
CID 160567647
1-[1-Benzyl-4-(isocyanomethyl)piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;3-(cyclopropanecarbonylamino)-1-[4-(isocyanomethyl)-1-[(2-methoxyphenyl)methyl]piperidin-4-yl]pyrazole-4-carboxamide;3-(cyclopropanecarbonylamino)-1-[4-(isocyanomethyl)-1-[(2-phenylphenyl)methyl]piperidin-4-yl]pyrazole-4-carboxamide;3-(cyclopropanecarbonylamino)-1-[4-(isocyanomethyl)-1-[(3-phenylphenyl)methyl]piperidin-4-yl]pyrazole-4-carboxamide;3-(cyclopropanecarbonylamino)-1-[4-(isocyanomethyl)-1-[(4-piperidin-1-ylphenyl)methyl]piperidin-4-yl]pyrazole-4-carboxamide
CID 161512870
1-[1-[(3-Anilinophenyl)methyl]-4-(cyanomethyl)piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[4-(cyanomethyl)-1-[(5-phenoxy-2-pyridinyl)methyl]piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[1-(cyanomethyl)-4-(3-phenylazetidin-1-yl)cyclohexyl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide
CID 161624451
1-[1-[(3-Cyano-4-phenylphenyl)methyl]-4-(isocyanomethyl)piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;3-(cyclopropanecarbonylamino)-1-[4-(isocyanomethyl)-1-[(3-methoxy-4-phenylphenyl)methyl]piperidin-4-yl]pyrazole-4-carboxamide;3-(cyclopropanecarbonylamino)-1-[4-(isocyanomethyl)-1-[(3-methyl-4-phenylphenyl)methyl]piperidin-4-yl]pyrazole-4-carboxamide;3-(cyclopropanecarbonylamino)-1-[4-(isocyanomethyl)-1-[(4-pyridin-3-ylphenyl)methyl]piperidin-4-yl]pyrazole-4-carboxamide;3-(cyclopropanecarbonylamino)-1-[4-(isocyanomethyl)-1-[(4-pyridin-4-ylphenyl)methyl]piperidin-4-yl]pyrazole-4-carboxamide
CID 161789788

Frequently Asked Questions

What is the IUPAC name of 1-[1-[(4-anilinophenyl)methyl]-4-(cyanomethyl)piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[1-[(4-benzylphenyl)methyl]-4-(cyanomethyl)piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[4-(cyanomethyl)-1-[(4-phenoxyphenyl)methyl]piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[4-(cyanomethyl)-1-[(6-phenoxy-3-pyridinyl)methyl]piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide?
The IUPAC name of 1-[1-[(4-anilinophenyl)methyl]-4-(cyanomethyl)piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[1-[(4-benzylphenyl)methyl]-4-(cyanomethyl)piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[4-(cyanomethyl)-1-[(4-phenoxyphenyl)methyl]piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[4-(cyanomethyl)-1-[(6-phenoxy-3-pyridinyl)methyl]piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide (CID 158948922) is 1-[1-[(4-anilinophenyl)methyl]-4-(cyanomethyl)piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[1-[(4-benzylphenyl)methyl]-4-(cyanomethyl)piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[4-(cyanomethyl)-1-[(4-phenoxyphenyl)methyl]piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[4-(cyanomethyl)-1-[(6-phenoxy-3-pyridinyl)methyl]piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide.
What is the SMILES notation for 1-[1-[(4-anilinophenyl)methyl]-4-(cyanomethyl)piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[1-[(4-benzylphenyl)methyl]-4-(cyanomethyl)piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[4-(cyanomethyl)-1-[(4-phenoxyphenyl)methyl]piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[4-(cyanomethyl)-1-[(6-phenoxy-3-pyridinyl)methyl]piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide?
The canonical SMILES for 1-[1-[(4-anilinophenyl)methyl]-4-(cyanomethyl)piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[1-[(4-benzylphenyl)methyl]-4-(cyanomethyl)piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[4-(cyanomethyl)-1-[(4-phenoxyphenyl)methyl]piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[4-(cyanomethyl)-1-[(6-phenoxy-3-pyridinyl)methyl]piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide is N#CCC1(n2cc(C(N)=O)c(NC(=O)C3CC3)n2)CCN(Cc2ccc(Cc3ccccc3)cc2)CC1.N#CCC1(n2cc(C(N)=O)c(NC(=O)C3CC3)n2)CCN(Cc2ccc(Nc3ccccc3)cc2)CC1.N#CCC1(n2cc(C(N)=O)c(NC(=O)C3CC3)n2)CCN(Cc2ccc(Oc3ccccc3)cc2)CC1.N#CCC1(n2cc(C(N)=O)c(NC(=O)C3CC3)n2)CCN(Cc2ccc(Oc3ccccc3)nc2)CC1.
What is the InChIKey of 1-[1-[(4-anilinophenyl)methyl]-4-(cyanomethyl)piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[1-[(4-benzylphenyl)methyl]-4-(cyanomethyl)piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[4-(cyanomethyl)-1-[(4-phenoxyphenyl)methyl]piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[4-(cyanomethyl)-1-[(6-phenoxy-3-pyridinyl)methyl]piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide?
The InChIKey is JLEDGYZIQWEMDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H32N6O2.C28H31N7O2.C28H30N6O3.C27H29N7O3/c30-15-12-29(35-20-25(26(31)36)27(33-35)32-28(37)24-10-11-24)13-16-34(17-14-29)19-23-8-6-22(7-9-23)18-21-4-2-1-3-5-21;29-15-12-28(35-19-24(25(30)36)26(33-35)32-27(37)21-8-9-21)13-16-34(17-14-28)18-20-6-10-23(11-7-20)31-22-4-2-1-3-5-22;29-15-12-28(34-19-24(25(30)35)26(32-34)31-27(36)21-8-9-21)13-16-33(17-14-28)18-20-6-10-23(11-7-20)37-22-4-2-1-3-5-22;28-13-10-27(34-18-22(24(29)35)25(32-34)31-26(36)20-7-8-20)11-14-33(15-12-27)17-19-6-9-23(30-16-19)37-21-4-2-1-3-5-21/h1-9,20,24H,10-14,16-19H2,(H2,31,36)(H,32,33,37);1-7,10-11,19,21,31H,8-9,12-14,16-18H2,(H2,30,36)(H,32,33,37);1-7,10-11,19,21H,8-9,12-14,16-18H2,(H2,30,35)(H,31,32,36);1-6,9,16,18,20H,7-8,10-12,14-15,17H2,(H2,29,35)(H,31,32,36).
What are the key properties of 1-[1-[(4-anilinophenyl)methyl]-4-(cyanomethyl)piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[1-[(4-benzylphenyl)methyl]-4-(cyanomethyl)piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[4-(cyanomethyl)-1-[(4-phenoxyphenyl)methyl]piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[4-(cyanomethyl)-1-[(6-phenoxy-3-pyridinyl)methyl]piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide?
1-[1-[(4-anilinophenyl)methyl]-4-(cyanomethyl)piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[1-[(4-benzylphenyl)methyl]-4-(cyanomethyl)piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[4-(cyanomethyl)-1-[(4-phenoxyphenyl)methyl]piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[4-(cyanomethyl)-1-[(6-phenoxy-3-pyridinyl)methyl]piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide has a molecular weight of 1992.38 g/mol, XLogP of 15.26, 36 rotatable bonds, 9 hydrogen bond donors, and 28 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[(4-anilinophenyl)methyl]-4-(cyanomethyl)piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[1-[(4-benzylphenyl)methyl]-4-(cyanomethyl)piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[4-(cyanomethyl)-1-[(4-phenoxyphenyl)methyl]piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide;1-[4-(cyanomethyl)-1-[(6-phenoxy-3-pyridinyl)methyl]piperidin-4-yl]-3-(cyclopropanecarbonylamino)pyrazole-4-carboxamide is sourced from PubChem (CID 158948922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).