tert-butyl 3-[[(6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carbonyl)amino]methyl]pyrrolidine-1-carboxylate;tert-butyl 3-[(6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carbonyl)amino]piperidine-1-carboxylate;N-[1-(dimethylamino)propan-2-yl]-6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-[(1-methylpiperidin-4-yl)methyl]-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-(1-methylpiperidin-4-yl)-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-[2-(1-methylpyrrolidin-2-yl)ethyl]-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-(1-methylpyrrolidin-3-yl)-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-7-oxo-N-(2-piperidin-1-ylethyl)-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;molecular hydrogen

C129H178N32O20 — CID 159346015

IUPACtert-butyl 3-[[(6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carbonyl)amino]methyl]pyrrolidine-1-carboxylate;tert-butyl 3-[(6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carbonyl)amino]piperidine-1-carboxylate;N-[1-(dimethylamino)propan-2-yl]-6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-[(1-methylpiperidin-4-yl)methyl]-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-(1-methylpiperidin-4-yl)-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-[2-(1-methylpyrrolidin-2-yl)ethyl]-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-(1-methylpyrrolidin-3-yl)-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-7-oxo-N-(2-piperidin-1-ylethyl)-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;molecular hydrogen
SMILESCC(CN(C)C)NC(=O)c1cn(C)c(=O)c2[nH]ccc12.CN1CCC(CNC(=O)c2cn(C)c(=O)c3[nH]ccc23)CC1.CN1CCC(NC(=O)c2cn(C)c(=O)c3[nH]ccc23)C1.CN1CCC(NC(=O)c2cn(C)c(=O)c3[nH]ccc23)CC1.CN1CCCC1CCNC(=O)c1cn(C)c(=O)c2[nH]ccc12.Cn1cc(C(=O)NC2CCCN(C(=O)OC(C)(C)C)C2)c2cc[nH]c2c1=O.Cn1cc(C(=O)NCC2CCN(C(=O)OC(C)(C)C)C2)c2cc[nH]c2c1=O.Cn1cc(C(=O)NCCN2CCCCC2)c2cc[nH]c2c1=O.[H][H]
InChIInChI=1S/2C19H26N4O4.3C16H22N4O2.C15H20N4O2.C14H18N4O2.C14H20N4O2.H2/c1-19(2,3)27-18(26)23-8-6-12(10-23)9-21-16(24)14-11-22(4)17(25)15-13(14)5-7-20-15;1-19(2,3)27-18(26)23-9-5-6-12(10-23)21-16(24)14-11-22(4)17(25)15-13(14)7-8-20-15;1-19-7-4-11(5-8-19)9-18-15(21)13-10-20(2)16(22)14-12(13)3-6-17-14;1-19-9-3-4-11(19)5-7-18-15(21)13-10-20(2)16(22)14-12(13)6-8-17-14;1-19-11-13(12-5-6-17-14(12)16(19)22)15(21)18-7-10-20-8-3-2-4-9-20;1-18-7-4-10(5-8-18)17-14(20)12-9-19(2)15(21)13-11(12)3-6-16-13;1-17-6-4-9(7-17)16-13(19)11-8-18(2)14(20)12-10(11)3-5-15-12;1-9(7-17(2)3)16-13(19)11-8-18(4)14(20)12-10(11)5-6-15-12;/h5,7,11-12,20H,6,8-10H2,1-4H3,(H,21,24);7-8,11-12,20H,5-6,9-10H2,1-4H3,(H,21,24);3,6,10-11,17H,4-5,7-9H2,1-2H3,(H,18,21);6,8,10-11,17H,3-5,7,9H2,1-2H3,(H,18,21);5-6,11,17H,2-4,7-10H2,1H3,(H,18,21);3,6,9-10,16H,4-5,7-8H2,1-2H3,(H,17,20);3,5,8-9,15H,4,6-7H2,1-2H3,(H,16,19);5-6,8-9,15H,7H2,1-4H3,(H,16,19);1H
InChIKeyLGSUAQMCIFUAJG-UHFFFAOYSA-N
MW2497.05 g/mol
LogP8.73
Rot. Bonds24

About tert-butyl 3-[[(6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carbonyl)amino]methyl]pyrrolidine-1-carboxylate;tert-butyl 3-[(6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carbonyl)amino]piperidine-1-carboxylate;N-[1-(dimethylamino)propan-2-yl]-6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-[(1-methylpiperidin-4-yl)methyl]-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-(1-methylpiperidin-4-yl)-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-[2-(1-methylpyrrolidin-2-yl)ethyl]-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-(1-methylpyrrolidin-3-yl)-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-7-oxo-N-(2-piperidin-1-ylethyl)-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;molecular hydrogen

tert-butyl 3-[[(6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carbonyl)amino]methyl]pyrrolidine-1-carboxylate;tert-butyl 3-[(6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carbonyl)amino]piperidine-1-carboxylate;N-[1-(dimethylamino)propan-2-yl]-6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-[(1-methylpiperidin-4-yl)methyl]-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-(1-methylpiperidin-4-yl)-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-[2-(1-methylpyrrolidin-2-yl)ethyl]-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-(1-methylpyrrolidin-3-yl)-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-7-oxo-N-(2-piperidin-1-ylethyl)-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;molecular hydrogen (PubChem CID 159346015) has the molecular formula C129H178N32O20 and a molecular weight of 2497.05 g/mol. Its IUPAC name is tert-butyl 3-[[(6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carbonyl)amino]methyl]pyrrolidine-1-carboxylate;tert-butyl 3-[(6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carbonyl)amino]piperidine-1-carboxylate;N-[1-(dimethylamino)propan-2-yl]-6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-[(1-methylpiperidin-4-yl)methyl]-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-(1-methylpiperidin-4-yl)-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-[2-(1-methylpyrrolidin-2-yl)ethyl]-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-(1-methylpyrrolidin-3-yl)-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-7-oxo-N-(2-piperidin-1-ylethyl)-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;molecular hydrogen.

Molecular Properties

Compound Nametert-butyl 3-[[(6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carbonyl)amino]methyl]pyrrolidine-1-carboxylate;tert-butyl 3-[(6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carbonyl)amino]piperidine-1-carboxylate;N-[1-(dimethylamino)propan-2-yl]-6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-[(1-methylpiperidin-4-yl)methyl]-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-(1-methylpiperidin-4-yl)-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-[2-(1-methylpyrrolidin-2-yl)ethyl]-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-(1-methylpyrrolidin-3-yl)-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-7-oxo-N-(2-piperidin-1-ylethyl)-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;molecular hydrogen
PubChem CID159346015
Molecular FormulaC129H178N32O20
Molecular Weight2497.05 g/mol
Exact Mass2495.39
IUPAC Nametert-butyl 3-[[(6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carbonyl)amino]methyl]pyrrolidine-1-carboxylate;tert-butyl 3-[(6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carbonyl)amino]piperidine-1-carboxylate;N-[1-(dimethylamino)propan-2-yl]-6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-[(1-methylpiperidin-4-yl)methyl]-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-(1-methylpiperidin-4-yl)-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-[2-(1-methylpyrrolidin-2-yl)ethyl]-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-(1-methylpyrrolidin-3-yl)-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-7-oxo-N-(2-piperidin-1-ylethyl)-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;molecular hydrogen
SMILESCC(CN(C)C)NC(=O)c1cn(C)c(=O)c2[nH]ccc12.CN1CCC(CNC(=O)c2cn(C)c(=O)c3[nH]ccc23)CC1.CN1CCC(NC(=O)c2cn(C)c(=O)c3[nH]ccc23)C1.CN1CCC(NC(=O)c2cn(C)c(=O)c3[nH]ccc23)CC1.CN1CCCC1CCNC(=O)c1cn(C)c(=O)c2[nH]ccc12.Cn1cc(C(=O)NC2CCCN(C(=O)OC(C)(C)C)C2)c2cc[nH]c2c1=O.Cn1cc(C(=O)NCC2CCN(C(=O)OC(C)(C)C)C2)c2cc[nH]c2c1=O.Cn1cc(C(=O)NCCN2CCCCC2)c2cc[nH]c2c1=O.[H][H]
InChIInChI=1S/2C19H26N4O4.3C16H22N4O2.C15H20N4O2.C14H18N4O2.C14H20N4O2.H2/c1-19(2,3)27-18(26)23-8-6-12(10-23)9-21-16(24)14-11-22(4)17(25)15-13(14)5-7-20-15;1-19(2,3)27-18(26)23-9-5-6-12(10-23)21-16(24)14-11-22(4)17(25)15-13(14)7-8-20-15;1-19-7-4-11(5-8-19)9-18-15(21)13-10-20(2)16(22)14-12(13)3-6-17-14;1-19-9-3-4-11(19)5-7-18-15(21)13-10-20(2)16(22)14-12(13)6-8-17-14;1-19-11-13(12-5-6-17-14(12)16(19)22)15(21)18-7-10-20-8-3-2-4-9-20;1-18-7-4-10(5-8-18)17-14(20)12-9-19(2)15(21)13-11(12)3-6-16-13;1-17-6-4-9(7-17)16-13(19)11-8-18(2)14(20)12-10(11)3-5-15-12;1-9(7-17(2)3)16-13(19)11-8-18(4)14(20)12-10(11)5-6-15-12;/h5,7,11-12,20H,6,8-10H2,1-4H3,(H,21,24);7-8,11-12,20H,5-6,9-10H2,1-4H3,(H,21,24);3,6,10-11,17H,4-5,7-9H2,1-2H3,(H,18,21);6,8,10-11,17H,3-5,7,9H2,1-2H3,(H,18,21);5-6,11,17H,2-4,7-10H2,1H3,(H,18,21);3,6,9-10,16H,4-5,7-8H2,1-2H3,(H,17,20);3,5,8-9,15H,4,6-7H2,1-2H3,(H,16,19);5-6,8-9,15H,7H2,1-4H3,(H,16,19);1H
InChIKeyLGSUAQMCIFUAJG-UHFFFAOYSA-N
XLogP8.73
TPSA613.64 Ų
H-Bond Donors16
H-Bond Acceptors34
Rotatable Bonds24
Heavy Atoms181
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002497.05
LogP ≤ 58.73
H-Bond Donors ≤ 516
H-Bond Acceptors ≤ 1034

Analyze tert-butyl 3-[[(6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carbonyl)amino]methyl]pyrrolidine-1-carboxylate;tert-butyl 3-[(6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carbonyl)amino]piperidine-1-carboxylate;N-[1-(dimethylamino)propan-2-yl]-6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-[(1-methylpiperidin-4-yl)methyl]-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-(1-methylpiperidin-4-yl)-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-[2-(1-methylpyrrolidin-2-yl)ethyl]-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-(1-methylpyrrolidin-3-yl)-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-7-oxo-N-(2-piperidin-1-ylethyl)-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;molecular hydrogen with MolForge

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Frequently Asked Questions

What is the IUPAC name of tert-butyl 3-[[(6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carbonyl)amino]methyl]pyrrolidine-1-carboxylate;tert-butyl 3-[(6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carbonyl)amino]piperidine-1-carboxylate;N-[1-(dimethylamino)propan-2-yl]-6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-[(1-methylpiperidin-4-yl)methyl]-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-(1-methylpiperidin-4-yl)-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-[2-(1-methylpyrrolidin-2-yl)ethyl]-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-(1-methylpyrrolidin-3-yl)-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-7-oxo-N-(2-piperidin-1-ylethyl)-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;molecular hydrogen?
The IUPAC name of tert-butyl 3-[[(6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carbonyl)amino]methyl]pyrrolidine-1-carboxylate;tert-butyl 3-[(6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carbonyl)amino]piperidine-1-carboxylate;N-[1-(dimethylamino)propan-2-yl]-6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-[(1-methylpiperidin-4-yl)methyl]-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-(1-methylpiperidin-4-yl)-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-[2-(1-methylpyrrolidin-2-yl)ethyl]-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-(1-methylpyrrolidin-3-yl)-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-7-oxo-N-(2-piperidin-1-ylethyl)-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;molecular hydrogen (CID 159346015) is tert-butyl 3-[[(6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carbonyl)amino]methyl]pyrrolidine-1-carboxylate;tert-butyl 3-[(6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carbonyl)amino]piperidine-1-carboxylate;N-[1-(dimethylamino)propan-2-yl]-6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-[(1-methylpiperidin-4-yl)methyl]-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-(1-methylpiperidin-4-yl)-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-[2-(1-methylpyrrolidin-2-yl)ethyl]-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-(1-methylpyrrolidin-3-yl)-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-7-oxo-N-(2-piperidin-1-ylethyl)-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;molecular hydrogen.
What is the SMILES notation for tert-butyl 3-[[(6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carbonyl)amino]methyl]pyrrolidine-1-carboxylate;tert-butyl 3-[(6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carbonyl)amino]piperidine-1-carboxylate;N-[1-(dimethylamino)propan-2-yl]-6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-[(1-methylpiperidin-4-yl)methyl]-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-(1-methylpiperidin-4-yl)-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-[2-(1-methylpyrrolidin-2-yl)ethyl]-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-(1-methylpyrrolidin-3-yl)-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-7-oxo-N-(2-piperidin-1-ylethyl)-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;molecular hydrogen?
The canonical SMILES for tert-butyl 3-[[(6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carbonyl)amino]methyl]pyrrolidine-1-carboxylate;tert-butyl 3-[(6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carbonyl)amino]piperidine-1-carboxylate;N-[1-(dimethylamino)propan-2-yl]-6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-[(1-methylpiperidin-4-yl)methyl]-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-(1-methylpiperidin-4-yl)-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-[2-(1-methylpyrrolidin-2-yl)ethyl]-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-(1-methylpyrrolidin-3-yl)-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-7-oxo-N-(2-piperidin-1-ylethyl)-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;molecular hydrogen is CC(CN(C)C)NC(=O)c1cn(C)c(=O)c2[nH]ccc12.CN1CCC(CNC(=O)c2cn(C)c(=O)c3[nH]ccc23)CC1.CN1CCC(NC(=O)c2cn(C)c(=O)c3[nH]ccc23)C1.CN1CCC(NC(=O)c2cn(C)c(=O)c3[nH]ccc23)CC1.CN1CCCC1CCNC(=O)c1cn(C)c(=O)c2[nH]ccc12.Cn1cc(C(=O)NC2CCCN(C(=O)OC(C)(C)C)C2)c2cc[nH]c2c1=O.Cn1cc(C(=O)NCC2CCN(C(=O)OC(C)(C)C)C2)c2cc[nH]c2c1=O.Cn1cc(C(=O)NCCN2CCCCC2)c2cc[nH]c2c1=O.[H][H].
What is the InChIKey of tert-butyl 3-[[(6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carbonyl)amino]methyl]pyrrolidine-1-carboxylate;tert-butyl 3-[(6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carbonyl)amino]piperidine-1-carboxylate;N-[1-(dimethylamino)propan-2-yl]-6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-[(1-methylpiperidin-4-yl)methyl]-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-(1-methylpiperidin-4-yl)-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-[2-(1-methylpyrrolidin-2-yl)ethyl]-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-(1-methylpyrrolidin-3-yl)-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-7-oxo-N-(2-piperidin-1-ylethyl)-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;molecular hydrogen?
The InChIKey is LGSUAQMCIFUAJG-UHFFFAOYSA-N. The full InChI is InChI=1S/2C19H26N4O4.3C16H22N4O2.C15H20N4O2.C14H18N4O2.C14H20N4O2.H2/c1-19(2,3)27-18(26)23-8-6-12(10-23)9-21-16(24)14-11-22(4)17(25)15-13(14)5-7-20-15;1-19(2,3)27-18(26)23-9-5-6-12(10-23)21-16(24)14-11-22(4)17(25)15-13(14)7-8-20-15;1-19-7-4-11(5-8-19)9-18-15(21)13-10-20(2)16(22)14-12(13)3-6-17-14;1-19-9-3-4-11(19)5-7-18-15(21)13-10-20(2)16(22)14-12(13)6-8-17-14;1-19-11-13(12-5-6-17-14(12)16(19)22)15(21)18-7-10-20-8-3-2-4-9-20;1-18-7-4-10(5-8-18)17-14(20)12-9-19(2)15(21)13-11(12)3-6-16-13;1-17-6-4-9(7-17)16-13(19)11-8-18(2)14(20)12-10(11)3-5-15-12;1-9(7-17(2)3)16-13(19)11-8-18(4)14(20)12-10(11)5-6-15-12;/h5,7,11-12,20H,6,8-10H2,1-4H3,(H,21,24);7-8,11-12,20H,5-6,9-10H2,1-4H3,(H,21,24);3,6,10-11,17H,4-5,7-9H2,1-2H3,(H,18,21);6,8,10-11,17H,3-5,7,9H2,1-2H3,(H,18,21);5-6,11,17H,2-4,7-10H2,1H3,(H,18,21);3,6,9-10,16H,4-5,7-8H2,1-2H3,(H,17,20);3,5,8-9,15H,4,6-7H2,1-2H3,(H,16,19);5-6,8-9,15H,7H2,1-4H3,(H,16,19);1H.
What are the key properties of tert-butyl 3-[[(6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carbonyl)amino]methyl]pyrrolidine-1-carboxylate;tert-butyl 3-[(6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carbonyl)amino]piperidine-1-carboxylate;N-[1-(dimethylamino)propan-2-yl]-6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-[(1-methylpiperidin-4-yl)methyl]-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-(1-methylpiperidin-4-yl)-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-[2-(1-methylpyrrolidin-2-yl)ethyl]-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-(1-methylpyrrolidin-3-yl)-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-7-oxo-N-(2-piperidin-1-ylethyl)-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;molecular hydrogen?
tert-butyl 3-[[(6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carbonyl)amino]methyl]pyrrolidine-1-carboxylate;tert-butyl 3-[(6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carbonyl)amino]piperidine-1-carboxylate;N-[1-(dimethylamino)propan-2-yl]-6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-[(1-methylpiperidin-4-yl)methyl]-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-(1-methylpiperidin-4-yl)-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-[2-(1-methylpyrrolidin-2-yl)ethyl]-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-(1-methylpyrrolidin-3-yl)-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-7-oxo-N-(2-piperidin-1-ylethyl)-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;molecular hydrogen has a molecular weight of 2497.05 g/mol, XLogP of 8.73, 24 rotatable bonds, 16 hydrogen bond donors, and 34 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl 3-[[(6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carbonyl)amino]methyl]pyrrolidine-1-carboxylate;tert-butyl 3-[(6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carbonyl)amino]piperidine-1-carboxylate;N-[1-(dimethylamino)propan-2-yl]-6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-[(1-methylpiperidin-4-yl)methyl]-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-(1-methylpiperidin-4-yl)-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-[2-(1-methylpyrrolidin-2-yl)ethyl]-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-N-(1-methylpyrrolidin-3-yl)-7-oxo-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;6-methyl-7-oxo-N-(2-piperidin-1-ylethyl)-1H-pyrrolo[2,3-c]pyridine-4-carboxamide;molecular hydrogen is sourced from PubChem (CID 159346015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).