2-methyl-5-piperazin-1-yl-1H-imidazo[4,5-b]pyridine;5-piperazin-1-yl-1,3-dihydropyrrolo[3,2-b]pyridin-2-one;5-piperazin-1-yl-1H-imidazo[4,5-b]pyridine;6-piperazin-1-yl-1H-imidazo[4,5-b]pyridine;6-piperazin-1-yl-3H-imidazo[4,5-c]pyridine;2-piperazin-1-yl-5H-pyrrolo[2,3-d]pyrimidine;5-piperazin-1-yl-2H-triazolo[4,5-b]pyridine;5-piperazin-1-yl-2-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine

C82H105F3N40O — CID 157249070

IUPAC2-methyl-5-piperazin-1-yl-1H-imidazo[4,5-b]pyridine;5-piperazin-1-yl-1,3-dihydropyrrolo[3,2-b]pyridin-2-one;5-piperazin-1-yl-1H-imidazo[4,5-b]pyridine;6-piperazin-1-yl-1H-imidazo[4,5-b]pyridine;6-piperazin-1-yl-3H-imidazo[4,5-c]pyridine;2-piperazin-1-yl-5H-pyrrolo[2,3-d]pyrimidine;5-piperazin-1-yl-2H-triazolo[4,5-b]pyridine;5-piperazin-1-yl-2-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine
SMILESC1=Nc2nc(N3CCNCC3)ncc2C1.Cc1nc2nc(N3CCNCC3)ccc2[nH]1.FC(F)(F)c1nc2nc(N3CCNCC3)ccc2[nH]1.O=C1Cc2nc(N3CCNCC3)ccc2N1.c1cc2n[nH]nc2nc1N1CCNCC1.c1nc2cc(N3CCNCC3)ncc2[nH]1.c1nc2nc(N3CCNCC3)ccc2[nH]1.c1nc2ncc(N3CCNCC3)cc2[nH]1
InChIInChI=1S/C11H12F3N5.C11H15N5.C11H14N4O.4C10H13N5.C9H12N6/c12-11(13,14)10-16-7-1-2-8(17-9(7)18-10)19-5-3-15-4-6-19;1-8-13-9-2-3-10(15-11(9)14-8)16-6-4-12-5-7-16;16-11-7-9-8(14-11)1-2-10(13-9)15-5-3-12-4-6-15;1-3-15(4-2-11-1)10-5-8-9(6-12-10)14-7-13-8;1-3-15(4-2-11-1)8-5-9-10(12-6-8)14-7-13-9;1-2-9(15-5-3-11-4-6-15)14-10-8(1)12-7-13-10;1-2-12-9-8(1)7-13-10(14-9)15-5-3-11-4-6-15;1-2-8(15-5-3-10-4-6-15)11-9-7(1)12-14-13-9/h1-2,15H,3-6H2,(H,16,17,18);2-3,12H,4-7H2,1H3,(H,13,14,15);1-2,12H,3-7H2,(H,14,16);5-7,11H,1-4H2,(H,13,14);5-7,11H,1-4H2,(H,12,13,14);1-2,7,11H,3-6H2,(H,12,13,14);2,7,11H,1,3-6H2;1-2,10H,3-6H2,(H,11,12,13,14)
InChIKeyAWCYCSIASHPXEL-UHFFFAOYSA-N
MW1724.01 g/mol
LogP3.06
Rot. Bonds8

About 2-methyl-5-piperazin-1-yl-1H-imidazo[4,5-b]pyridine;5-piperazin-1-yl-1,3-dihydropyrrolo[3,2-b]pyridin-2-one;5-piperazin-1-yl-1H-imidazo[4,5-b]pyridine;6-piperazin-1-yl-1H-imidazo[4,5-b]pyridine;6-piperazin-1-yl-3H-imidazo[4,5-c]pyridine;2-piperazin-1-yl-5H-pyrrolo[2,3-d]pyrimidine;5-piperazin-1-yl-2H-triazolo[4,5-b]pyridine;5-piperazin-1-yl-2-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine

2-methyl-5-piperazin-1-yl-1H-imidazo[4,5-b]pyridine;5-piperazin-1-yl-1,3-dihydropyrrolo[3,2-b]pyridin-2-one;5-piperazin-1-yl-1H-imidazo[4,5-b]pyridine;6-piperazin-1-yl-1H-imidazo[4,5-b]pyridine;6-piperazin-1-yl-3H-imidazo[4,5-c]pyridine;2-piperazin-1-yl-5H-pyrrolo[2,3-d]pyrimidine;5-piperazin-1-yl-2H-triazolo[4,5-b]pyridine;5-piperazin-1-yl-2-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine (PubChem CID 157249070) has the molecular formula C82H105F3N40O and a molecular weight of 1724.01 g/mol. Its IUPAC name is 2-methyl-5-piperazin-1-yl-1H-imidazo[4,5-b]pyridine;5-piperazin-1-yl-1,3-dihydropyrrolo[3,2-b]pyridin-2-one;5-piperazin-1-yl-1H-imidazo[4,5-b]pyridine;6-piperazin-1-yl-1H-imidazo[4,5-b]pyridine;6-piperazin-1-yl-3H-imidazo[4,5-c]pyridine;2-piperazin-1-yl-5H-pyrrolo[2,3-d]pyrimidine;5-piperazin-1-yl-2H-triazolo[4,5-b]pyridine;5-piperazin-1-yl-2-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name2-methyl-5-piperazin-1-yl-1H-imidazo[4,5-b]pyridine;5-piperazin-1-yl-1,3-dihydropyrrolo[3,2-b]pyridin-2-one;5-piperazin-1-yl-1H-imidazo[4,5-b]pyridine;6-piperazin-1-yl-1H-imidazo[4,5-b]pyridine;6-piperazin-1-yl-3H-imidazo[4,5-c]pyridine;2-piperazin-1-yl-5H-pyrrolo[2,3-d]pyrimidine;5-piperazin-1-yl-2H-triazolo[4,5-b]pyridine;5-piperazin-1-yl-2-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine
PubChem CID157249070
Molecular FormulaC82H105F3N40O
Molecular Weight1724.01 g/mol
Exact Mass1722.93
IUPAC Name2-methyl-5-piperazin-1-yl-1H-imidazo[4,5-b]pyridine;5-piperazin-1-yl-1,3-dihydropyrrolo[3,2-b]pyridin-2-one;5-piperazin-1-yl-1H-imidazo[4,5-b]pyridine;6-piperazin-1-yl-1H-imidazo[4,5-b]pyridine;6-piperazin-1-yl-3H-imidazo[4,5-c]pyridine;2-piperazin-1-yl-5H-pyrrolo[2,3-d]pyrimidine;5-piperazin-1-yl-2H-triazolo[4,5-b]pyridine;5-piperazin-1-yl-2-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine
SMILESC1=Nc2nc(N3CCNCC3)ncc2C1.Cc1nc2nc(N3CCNCC3)ccc2[nH]1.FC(F)(F)c1nc2nc(N3CCNCC3)ccc2[nH]1.O=C1Cc2nc(N3CCNCC3)ccc2N1.c1cc2n[nH]nc2nc1N1CCNCC1.c1nc2cc(N3CCNCC3)ncc2[nH]1.c1nc2nc(N3CCNCC3)ccc2[nH]1.c1nc2ncc(N3CCNCC3)cc2[nH]1
InChIInChI=1S/C11H12F3N5.C11H15N5.C11H14N4O.4C10H13N5.C9H12N6/c12-11(13,14)10-16-7-1-2-8(17-9(7)18-10)19-5-3-15-4-6-19;1-8-13-9-2-3-10(15-11(9)14-8)16-6-4-12-5-7-16;16-11-7-9-8(14-11)1-2-10(13-9)15-5-3-12-4-6-15;1-3-15(4-2-11-1)10-5-8-9(6-12-10)14-7-13-8;1-3-15(4-2-11-1)8-5-9-10(12-6-8)14-7-13-9;1-2-9(15-5-3-11-4-6-15)14-10-8(1)12-7-13-10;1-2-12-9-8(1)7-13-10(14-9)15-5-3-11-4-6-15;1-2-8(15-5-3-10-4-6-15)11-9-7(1)12-14-13-9/h1-2,15H,3-6H2,(H,16,17,18);2-3,12H,4-7H2,1H3,(H,13,14,15);1-2,12H,3-7H2,(H,14,16);5-7,11H,1-4H2,(H,13,14);5-7,11H,1-4H2,(H,12,13,14);1-2,7,11H,3-6H2,(H,12,13,14);2,7,11H,1,3-6H2;1-2,10H,3-6H2,(H,11,12,13,14)
InChIKeyAWCYCSIASHPXEL-UHFFFAOYSA-N
XLogP3.06
TPSA464.60 Ų
H-Bond Donors15
H-Bond Acceptors34
Rotatable Bonds8
Heavy Atoms126
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001724.01
LogP ≤ 53.06
H-Bond Donors ≤ 515
H-Bond Acceptors ≤ 1034

Analyze 2-methyl-5-piperazin-1-yl-1H-imidazo[4,5-b]pyridine;5-piperazin-1-yl-1,3-dihydropyrrolo[3,2-b]pyridin-2-one;5-piperazin-1-yl-1H-imidazo[4,5-b]pyridine;6-piperazin-1-yl-1H-imidazo[4,5-b]pyridine;6-piperazin-1-yl-3H-imidazo[4,5-c]pyridine;2-piperazin-1-yl-5H-pyrrolo[2,3-d]pyrimidine;5-piperazin-1-yl-2H-triazolo[4,5-b]pyridine;5-piperazin-1-yl-2-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine with MolForge

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Related Compounds

N-[5-[3-[7-(4-methylpiperazin-1-yl)-3H-imidazo[4,5-c]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]cyclohexanecarboxamide
CID 136213870
1-[4-[[3-(6-amino-2-methylpyrimidin-4-yl)imidazo[1,2-b]pyridazin-2-yl]amino]phenyl]-3-cyclopropylurea;1-[4-[[3-(6-amino-2-methylpyrimidin-4-yl)imidazo[1,2-b]pyridazin-2-yl]amino]phenyl]-3-ethylurea;3-(6-amino-2-methylpyrimidin-4-yl)-N-(1H-pyrazol-5-yl)-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-amine
CID 87151742
3,8-dimethyl-6-[2-(1-methyl-4-pyridin-2-ylimidazol-2-yl)ethyl]-2-(trifluoromethyl)imidazo[1,2-b]pyridazine;N,3-dimethyl-6-[2-(1-methyl-4-pyridin-2-ylimidazol-2-yl)ethyl]-2-(trifluoromethyl)imidazo[1,2-b]pyridazine-8-carboxamide
CID 118278222
N-[4-[[6-(3,3-difluoropyrrolidin-1-yl)-3-[(4,6-dimethyl-2-pyridinyl)carbamoyl]imidazo[1,2-b]pyridazin-1-ium-1-yl]methyl]-6-methyl-2-pyridinyl]-6-(3-fluoropyrrolidin-1-yl)-1-[2-[[6-(3-fluoropyrrolidin-1-yl)imidazo[1,2-b]pyridazine-3-carbonyl]amino]-6-methyl-4-pyridinyl]imidazo[1,2-b]pyridazin-1-ium-3-carboxamide
CID 123839257
[2-[6-[(3aS,7aR)-6-[2-[4-ethenyl-5-(methylideneamino)-1-(2,2,2-trifluoroethyl)pyrrol-2-yl]-3-methylimidazo[4,5-b]pyridine-6-carbonyl]-1,2,3,3a,4,5,7,7a-octahydropyrrolo[2,3-c]pyridin-2-yl]-1-(2,2,2-trifluoroethyl)pyrrolo[2,3-b]pyridin-2-yl]-3-methylimidazo[4,5-b]pyridin-6-yl]-(1,2,3,3a,4,5,7,7a-octahydropyrrolo[2,3-c]pyridin-6-yl)methanone
CID 129235992
[(3R)-3-aminopiperidin-1-yl]-[3-methyl-2-[5-[6-[3-methyl-2-[1-(2,2,2-trifluoroethyl)pyrrolo[2,3-b]pyridin-2-yl]imidazo[4,5-b]pyridine-6-carbonyl]-1,2,3,3a,4,5,7,7a-octahydropyrrolo[2,3-c]pyridin-2-yl]-1-(2,2,2-trifluoroethyl)pyrrolo[2,3-b]pyridin-2-yl]imidazo[4,5-b]pyridin-6-yl]methanone
CID 129236564
N-[5-[3-[7-(3-fluorophenyl)-3H-imidazo[4,5-c]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]-1-methylpiperidine-4-carboxamide
CID 136193203
N-[5-[3-[7-(2-fluorophenyl)-3H-imidazo[4,5-c]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]-1-methylpiperidine-4-carboxamide
CID 136193272
N-[5-[3-[7-(4-fluorophenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]-1-methylpiperidine-4-carboxamide
CID 136193528
N-[5-[3-[7-(4-fluorophenyl)-3H-imidazo[4,5-c]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]-1-methylpiperidine-4-carboxamide
CID 136193557
N-[5-[3-[7-(2-fluorophenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]-1-methylpiperidine-4-carboxamide
CID 136193629
N-[5-[3-[7-(3-fluorophenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]-1-methylpiperidine-4-carboxamide
CID 136193643

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-piperazin-1-yl-1H-imidazo[4,5-b]pyridine;5-piperazin-1-yl-1,3-dihydropyrrolo[3,2-b]pyridin-2-one;5-piperazin-1-yl-1H-imidazo[4,5-b]pyridine;6-piperazin-1-yl-1H-imidazo[4,5-b]pyridine;6-piperazin-1-yl-3H-imidazo[4,5-c]pyridine;2-piperazin-1-yl-5H-pyrrolo[2,3-d]pyrimidine;5-piperazin-1-yl-2H-triazolo[4,5-b]pyridine;5-piperazin-1-yl-2-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine?
The IUPAC name of 2-methyl-5-piperazin-1-yl-1H-imidazo[4,5-b]pyridine;5-piperazin-1-yl-1,3-dihydropyrrolo[3,2-b]pyridin-2-one;5-piperazin-1-yl-1H-imidazo[4,5-b]pyridine;6-piperazin-1-yl-1H-imidazo[4,5-b]pyridine;6-piperazin-1-yl-3H-imidazo[4,5-c]pyridine;2-piperazin-1-yl-5H-pyrrolo[2,3-d]pyrimidine;5-piperazin-1-yl-2H-triazolo[4,5-b]pyridine;5-piperazin-1-yl-2-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine (CID 157249070) is 2-methyl-5-piperazin-1-yl-1H-imidazo[4,5-b]pyridine;5-piperazin-1-yl-1,3-dihydropyrrolo[3,2-b]pyridin-2-one;5-piperazin-1-yl-1H-imidazo[4,5-b]pyridine;6-piperazin-1-yl-1H-imidazo[4,5-b]pyridine;6-piperazin-1-yl-3H-imidazo[4,5-c]pyridine;2-piperazin-1-yl-5H-pyrrolo[2,3-d]pyrimidine;5-piperazin-1-yl-2H-triazolo[4,5-b]pyridine;5-piperazin-1-yl-2-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine.
What is the SMILES notation for 2-methyl-5-piperazin-1-yl-1H-imidazo[4,5-b]pyridine;5-piperazin-1-yl-1,3-dihydropyrrolo[3,2-b]pyridin-2-one;5-piperazin-1-yl-1H-imidazo[4,5-b]pyridine;6-piperazin-1-yl-1H-imidazo[4,5-b]pyridine;6-piperazin-1-yl-3H-imidazo[4,5-c]pyridine;2-piperazin-1-yl-5H-pyrrolo[2,3-d]pyrimidine;5-piperazin-1-yl-2H-triazolo[4,5-b]pyridine;5-piperazin-1-yl-2-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine?
The canonical SMILES for 2-methyl-5-piperazin-1-yl-1H-imidazo[4,5-b]pyridine;5-piperazin-1-yl-1,3-dihydropyrrolo[3,2-b]pyridin-2-one;5-piperazin-1-yl-1H-imidazo[4,5-b]pyridine;6-piperazin-1-yl-1H-imidazo[4,5-b]pyridine;6-piperazin-1-yl-3H-imidazo[4,5-c]pyridine;2-piperazin-1-yl-5H-pyrrolo[2,3-d]pyrimidine;5-piperazin-1-yl-2H-triazolo[4,5-b]pyridine;5-piperazin-1-yl-2-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine is C1=Nc2nc(N3CCNCC3)ncc2C1.Cc1nc2nc(N3CCNCC3)ccc2[nH]1.FC(F)(F)c1nc2nc(N3CCNCC3)ccc2[nH]1.O=C1Cc2nc(N3CCNCC3)ccc2N1.c1cc2n[nH]nc2nc1N1CCNCC1.c1nc2cc(N3CCNCC3)ncc2[nH]1.c1nc2nc(N3CCNCC3)ccc2[nH]1.c1nc2ncc(N3CCNCC3)cc2[nH]1.
What is the InChIKey of 2-methyl-5-piperazin-1-yl-1H-imidazo[4,5-b]pyridine;5-piperazin-1-yl-1,3-dihydropyrrolo[3,2-b]pyridin-2-one;5-piperazin-1-yl-1H-imidazo[4,5-b]pyridine;6-piperazin-1-yl-1H-imidazo[4,5-b]pyridine;6-piperazin-1-yl-3H-imidazo[4,5-c]pyridine;2-piperazin-1-yl-5H-pyrrolo[2,3-d]pyrimidine;5-piperazin-1-yl-2H-triazolo[4,5-b]pyridine;5-piperazin-1-yl-2-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine?
The InChIKey is AWCYCSIASHPXEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12F3N5.C11H15N5.C11H14N4O.4C10H13N5.C9H12N6/c12-11(13,14)10-16-7-1-2-8(17-9(7)18-10)19-5-3-15-4-6-19;1-8-13-9-2-3-10(15-11(9)14-8)16-6-4-12-5-7-16;16-11-7-9-8(14-11)1-2-10(13-9)15-5-3-12-4-6-15;1-3-15(4-2-11-1)10-5-8-9(6-12-10)14-7-13-8;1-3-15(4-2-11-1)8-5-9-10(12-6-8)14-7-13-9;1-2-9(15-5-3-11-4-6-15)14-10-8(1)12-7-13-10;1-2-12-9-8(1)7-13-10(14-9)15-5-3-11-4-6-15;1-2-8(15-5-3-10-4-6-15)11-9-7(1)12-14-13-9/h1-2,15H,3-6H2,(H,16,17,18);2-3,12H,4-7H2,1H3,(H,13,14,15);1-2,12H,3-7H2,(H,14,16);5-7,11H,1-4H2,(H,13,14);5-7,11H,1-4H2,(H,12,13,14);1-2,7,11H,3-6H2,(H,12,13,14);2,7,11H,1,3-6H2;1-2,10H,3-6H2,(H,11,12,13,14).
What are the key properties of 2-methyl-5-piperazin-1-yl-1H-imidazo[4,5-b]pyridine;5-piperazin-1-yl-1,3-dihydropyrrolo[3,2-b]pyridin-2-one;5-piperazin-1-yl-1H-imidazo[4,5-b]pyridine;6-piperazin-1-yl-1H-imidazo[4,5-b]pyridine;6-piperazin-1-yl-3H-imidazo[4,5-c]pyridine;2-piperazin-1-yl-5H-pyrrolo[2,3-d]pyrimidine;5-piperazin-1-yl-2H-triazolo[4,5-b]pyridine;5-piperazin-1-yl-2-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine?
2-methyl-5-piperazin-1-yl-1H-imidazo[4,5-b]pyridine;5-piperazin-1-yl-1,3-dihydropyrrolo[3,2-b]pyridin-2-one;5-piperazin-1-yl-1H-imidazo[4,5-b]pyridine;6-piperazin-1-yl-1H-imidazo[4,5-b]pyridine;6-piperazin-1-yl-3H-imidazo[4,5-c]pyridine;2-piperazin-1-yl-5H-pyrrolo[2,3-d]pyrimidine;5-piperazin-1-yl-2H-triazolo[4,5-b]pyridine;5-piperazin-1-yl-2-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine has a molecular weight of 1724.01 g/mol, XLogP of 3.06, 8 rotatable bonds, 15 hydrogen bond donors, and 34 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-piperazin-1-yl-1H-imidazo[4,5-b]pyridine;5-piperazin-1-yl-1,3-dihydropyrrolo[3,2-b]pyridin-2-one;5-piperazin-1-yl-1H-imidazo[4,5-b]pyridine;6-piperazin-1-yl-1H-imidazo[4,5-b]pyridine;6-piperazin-1-yl-3H-imidazo[4,5-c]pyridine;2-piperazin-1-yl-5H-pyrrolo[2,3-d]pyrimidine;5-piperazin-1-yl-2H-triazolo[4,5-b]pyridine;5-piperazin-1-yl-2-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine is sourced from PubChem (CID 157249070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).