1H-imidazo[4,5-b]pyridine;2-methylpropane;2-propan-2-yl-1H-benzimidazole;2-propan-2-yl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine;2-propan-2-ylimidazo[1,2-a]pyrazine;2-propan-2-ylimidazo[1,2-a]pyridine;2-propan-2-ylimidazo[1,2-a]pyrimidine;6-propan-2-ylimidazo[2,1-b][1,3]thiazole;3-propan-2-yl-1,2,5-oxadiazole;3-propan-2-ylpyridazine;2-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;3-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole

C97H135N25O2S — CID 158552798

IUPAC1H-imidazo[4,5-b]pyridine;2-methylpropane;2-propan-2-yl-1H-benzimidazole;2-propan-2-yl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine;2-propan-2-ylimidazo[1,2-a]pyrazine;2-propan-2-ylimidazo[1,2-a]pyridine;2-propan-2-ylimidazo[1,2-a]pyrimidine;6-propan-2-ylimidazo[2,1-b][1,3]thiazole;3-propan-2-yl-1,2,5-oxadiazole;3-propan-2-ylpyridazine;2-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;3-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole
SMILESCC(C)C.CC(C)c1cc2n(n1)CCCO2.CC(C)c1cccnn1.CC(C)c1cn2c(n1)CCCC2.CC(C)c1cn2ccccc2n1.CC(C)c1cn2cccnc2n1.CC(C)c1cn2ccncc2n1.CC(C)c1cn2ccsc2n1.CC(C)c1cnon1.CC(C)c1n[nH]c2c1CCCC2.CC(C)c1nc2ccccc2[nH]1.c1cnc2nc[nH]c2c1
InChIInChI=1S/C10H16N2.2C10H12N2.C10H16N2.2C9H11N3.C9H14N2O.C8H10N2S.C7H10N2.C6H5N3.C5H8N2O.C4H10/c2*1-8(2)9-7-12-6-4-3-5-10(12)11-9;1-7(2)10-11-8-5-3-4-6-9(8)12-10;1-7(2)10-8-5-3-4-6-9(8)11-12-10;1-7(2)8-6-12-4-3-10-5-9(12)11-8;1-7(2)8-6-12-5-3-4-10-9(12)11-8;1-7(2)8-6-9-11(10-8)4-3-5-12-9;1-6(2)7-5-10-3-4-11-8(10)9-7;1-6(2)7-4-3-5-8-9-7;1-2-5-6(7-3-1)9-4-8-5;1-4(2)5-3-6-8-7-5;1-4(2)3/h7-8H,3-6H2,1-2H3;3-8H,1-2H3;3-7H,1-2H3,(H,11,12);7H,3-6H2,1-2H3,(H,11,12);2*3-7H,1-2H3;6-7H,3-5H2,1-2H3;3-6H,1-2H3;3-6H,1-2H3;1-4H,(H,7,8,9);3-4H,1-2H3;4H,1-3H3
InChIKeyHPXURPXFVLTYPG-UHFFFAOYSA-N
MW1715.39 g/mol
LogP23.33
Rot. Bonds10

About 1H-imidazo[4,5-b]pyridine;2-methylpropane;2-propan-2-yl-1H-benzimidazole;2-propan-2-yl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine;2-propan-2-ylimidazo[1,2-a]pyrazine;2-propan-2-ylimidazo[1,2-a]pyridine;2-propan-2-ylimidazo[1,2-a]pyrimidine;6-propan-2-ylimidazo[2,1-b][1,3]thiazole;3-propan-2-yl-1,2,5-oxadiazole;3-propan-2-ylpyridazine;2-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;3-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole

1H-imidazo[4,5-b]pyridine;2-methylpropane;2-propan-2-yl-1H-benzimidazole;2-propan-2-yl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine;2-propan-2-ylimidazo[1,2-a]pyrazine;2-propan-2-ylimidazo[1,2-a]pyridine;2-propan-2-ylimidazo[1,2-a]pyrimidine;6-propan-2-ylimidazo[2,1-b][1,3]thiazole;3-propan-2-yl-1,2,5-oxadiazole;3-propan-2-ylpyridazine;2-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;3-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole (PubChem CID 158552798) has the molecular formula C97H135N25O2S and a molecular weight of 1715.39 g/mol. Its IUPAC name is 1H-imidazo[4,5-b]pyridine;2-methylpropane;2-propan-2-yl-1H-benzimidazole;2-propan-2-yl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine;2-propan-2-ylimidazo[1,2-a]pyrazine;2-propan-2-ylimidazo[1,2-a]pyridine;2-propan-2-ylimidazo[1,2-a]pyrimidine;6-propan-2-ylimidazo[2,1-b][1,3]thiazole;3-propan-2-yl-1,2,5-oxadiazole;3-propan-2-ylpyridazine;2-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;3-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole.

Molecular Properties

Compound Name1H-imidazo[4,5-b]pyridine;2-methylpropane;2-propan-2-yl-1H-benzimidazole;2-propan-2-yl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine;2-propan-2-ylimidazo[1,2-a]pyrazine;2-propan-2-ylimidazo[1,2-a]pyridine;2-propan-2-ylimidazo[1,2-a]pyrimidine;6-propan-2-ylimidazo[2,1-b][1,3]thiazole;3-propan-2-yl-1,2,5-oxadiazole;3-propan-2-ylpyridazine;2-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;3-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole
PubChem CID158552798
Molecular FormulaC97H135N25O2S
Molecular Weight1715.39 g/mol
Exact Mass1714.10
IUPAC Name1H-imidazo[4,5-b]pyridine;2-methylpropane;2-propan-2-yl-1H-benzimidazole;2-propan-2-yl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine;2-propan-2-ylimidazo[1,2-a]pyrazine;2-propan-2-ylimidazo[1,2-a]pyridine;2-propan-2-ylimidazo[1,2-a]pyrimidine;6-propan-2-ylimidazo[2,1-b][1,3]thiazole;3-propan-2-yl-1,2,5-oxadiazole;3-propan-2-ylpyridazine;2-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;3-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole
SMILESCC(C)C.CC(C)c1cc2n(n1)CCCO2.CC(C)c1cccnn1.CC(C)c1cn2c(n1)CCCC2.CC(C)c1cn2ccccc2n1.CC(C)c1cn2cccnc2n1.CC(C)c1cn2ccncc2n1.CC(C)c1cn2ccsc2n1.CC(C)c1cnon1.CC(C)c1n[nH]c2c1CCCC2.CC(C)c1nc2ccccc2[nH]1.c1cnc2nc[nH]c2c1
InChIInChI=1S/C10H16N2.2C10H12N2.C10H16N2.2C9H11N3.C9H14N2O.C8H10N2S.C7H10N2.C6H5N3.C5H8N2O.C4H10/c2*1-8(2)9-7-12-6-4-3-5-10(12)11-9;1-7(2)10-11-8-5-3-4-6-9(8)12-10;1-7(2)10-8-5-3-4-6-9(8)11-12-10;1-7(2)8-6-12-4-3-10-5-9(12)11-8;1-7(2)8-6-12-5-3-4-10-9(12)11-8;1-7(2)8-6-9-11(10-8)4-3-5-12-9;1-6(2)7-5-10-3-4-11-8(10)9-7;1-6(2)7-4-3-5-8-9-7;1-2-5-6(7-3-1)9-4-8-5;1-4(2)5-3-6-8-7-5;1-4(2)3/h7-8H,3-6H2,1-2H3;3-8H,1-2H3;3-7H,1-2H3,(H,11,12);7H,3-6H2,1-2H3,(H,11,12);2*3-7H,1-2H3;6-7H,3-5H2,1-2H3;3-6H,1-2H3;3-6H,1-2H3;1-4H,(H,7,8,9);3-4H,1-2H3;4H,1-3H3
InChIKeyHPXURPXFVLTYPG-UHFFFAOYSA-N
XLogP23.33
TPSA303.48 Ų
H-Bond Donors3
H-Bond Acceptors25
Rotatable Bonds10
Heavy Atoms125
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001715.39
LogP ≤ 523.33
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1025

Analyze 1H-imidazo[4,5-b]pyridine;2-methylpropane;2-propan-2-yl-1H-benzimidazole;2-propan-2-yl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine;2-propan-2-ylimidazo[1,2-a]pyrazine;2-propan-2-ylimidazo[1,2-a]pyridine;2-propan-2-ylimidazo[1,2-a]pyrimidine;6-propan-2-ylimidazo[2,1-b][1,3]thiazole;3-propan-2-yl-1,2,5-oxadiazole;3-propan-2-ylpyridazine;2-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;3-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1H-imidazo[4,5-b]pyridine;2-methylpropane;2-propan-2-yl-1H-benzimidazole;2-propan-2-yl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine;2-propan-2-ylimidazo[1,2-a]pyrazine;2-propan-2-ylimidazo[1,2-a]pyridine;2-propan-2-ylimidazo[1,2-a]pyrimidine;6-propan-2-ylimidazo[2,1-b][1,3]thiazole;3-propan-2-yl-1,2,5-oxadiazole;3-propan-2-ylpyridazine;2-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;3-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole?
The IUPAC name of 1H-imidazo[4,5-b]pyridine;2-methylpropane;2-propan-2-yl-1H-benzimidazole;2-propan-2-yl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine;2-propan-2-ylimidazo[1,2-a]pyrazine;2-propan-2-ylimidazo[1,2-a]pyridine;2-propan-2-ylimidazo[1,2-a]pyrimidine;6-propan-2-ylimidazo[2,1-b][1,3]thiazole;3-propan-2-yl-1,2,5-oxadiazole;3-propan-2-ylpyridazine;2-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;3-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole (CID 158552798) is 1H-imidazo[4,5-b]pyridine;2-methylpropane;2-propan-2-yl-1H-benzimidazole;2-propan-2-yl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine;2-propan-2-ylimidazo[1,2-a]pyrazine;2-propan-2-ylimidazo[1,2-a]pyridine;2-propan-2-ylimidazo[1,2-a]pyrimidine;6-propan-2-ylimidazo[2,1-b][1,3]thiazole;3-propan-2-yl-1,2,5-oxadiazole;3-propan-2-ylpyridazine;2-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;3-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole.
What is the SMILES notation for 1H-imidazo[4,5-b]pyridine;2-methylpropane;2-propan-2-yl-1H-benzimidazole;2-propan-2-yl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine;2-propan-2-ylimidazo[1,2-a]pyrazine;2-propan-2-ylimidazo[1,2-a]pyridine;2-propan-2-ylimidazo[1,2-a]pyrimidine;6-propan-2-ylimidazo[2,1-b][1,3]thiazole;3-propan-2-yl-1,2,5-oxadiazole;3-propan-2-ylpyridazine;2-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;3-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole?
The canonical SMILES for 1H-imidazo[4,5-b]pyridine;2-methylpropane;2-propan-2-yl-1H-benzimidazole;2-propan-2-yl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine;2-propan-2-ylimidazo[1,2-a]pyrazine;2-propan-2-ylimidazo[1,2-a]pyridine;2-propan-2-ylimidazo[1,2-a]pyrimidine;6-propan-2-ylimidazo[2,1-b][1,3]thiazole;3-propan-2-yl-1,2,5-oxadiazole;3-propan-2-ylpyridazine;2-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;3-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole is CC(C)C.CC(C)c1cc2n(n1)CCCO2.CC(C)c1cccnn1.CC(C)c1cn2c(n1)CCCC2.CC(C)c1cn2ccccc2n1.CC(C)c1cn2cccnc2n1.CC(C)c1cn2ccncc2n1.CC(C)c1cn2ccsc2n1.CC(C)c1cnon1.CC(C)c1n[nH]c2c1CCCC2.CC(C)c1nc2ccccc2[nH]1.c1cnc2nc[nH]c2c1.
What is the InChIKey of 1H-imidazo[4,5-b]pyridine;2-methylpropane;2-propan-2-yl-1H-benzimidazole;2-propan-2-yl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine;2-propan-2-ylimidazo[1,2-a]pyrazine;2-propan-2-ylimidazo[1,2-a]pyridine;2-propan-2-ylimidazo[1,2-a]pyrimidine;6-propan-2-ylimidazo[2,1-b][1,3]thiazole;3-propan-2-yl-1,2,5-oxadiazole;3-propan-2-ylpyridazine;2-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;3-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole?
The InChIKey is HPXURPXFVLTYPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2.2C10H12N2.C10H16N2.2C9H11N3.C9H14N2O.C8H10N2S.C7H10N2.C6H5N3.C5H8N2O.C4H10/c2*1-8(2)9-7-12-6-4-3-5-10(12)11-9;1-7(2)10-11-8-5-3-4-6-9(8)12-10;1-7(2)10-8-5-3-4-6-9(8)11-12-10;1-7(2)8-6-12-4-3-10-5-9(12)11-8;1-7(2)8-6-12-5-3-4-10-9(12)11-8;1-7(2)8-6-9-11(10-8)4-3-5-12-9;1-6(2)7-5-10-3-4-11-8(10)9-7;1-6(2)7-4-3-5-8-9-7;1-2-5-6(7-3-1)9-4-8-5;1-4(2)5-3-6-8-7-5;1-4(2)3/h7-8H,3-6H2,1-2H3;3-8H,1-2H3;3-7H,1-2H3,(H,11,12);7H,3-6H2,1-2H3,(H,11,12);2*3-7H,1-2H3;6-7H,3-5H2,1-2H3;3-6H,1-2H3;3-6H,1-2H3;1-4H,(H,7,8,9);3-4H,1-2H3;4H,1-3H3.
What are the key properties of 1H-imidazo[4,5-b]pyridine;2-methylpropane;2-propan-2-yl-1H-benzimidazole;2-propan-2-yl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine;2-propan-2-ylimidazo[1,2-a]pyrazine;2-propan-2-ylimidazo[1,2-a]pyridine;2-propan-2-ylimidazo[1,2-a]pyrimidine;6-propan-2-ylimidazo[2,1-b][1,3]thiazole;3-propan-2-yl-1,2,5-oxadiazole;3-propan-2-ylpyridazine;2-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;3-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole?
1H-imidazo[4,5-b]pyridine;2-methylpropane;2-propan-2-yl-1H-benzimidazole;2-propan-2-yl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine;2-propan-2-ylimidazo[1,2-a]pyrazine;2-propan-2-ylimidazo[1,2-a]pyridine;2-propan-2-ylimidazo[1,2-a]pyrimidine;6-propan-2-ylimidazo[2,1-b][1,3]thiazole;3-propan-2-yl-1,2,5-oxadiazole;3-propan-2-ylpyridazine;2-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;3-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole has a molecular weight of 1715.39 g/mol, XLogP of 23.33, 10 rotatable bonds, 3 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for 1H-imidazo[4,5-b]pyridine;2-methylpropane;2-propan-2-yl-1H-benzimidazole;2-propan-2-yl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine;2-propan-2-ylimidazo[1,2-a]pyrazine;2-propan-2-ylimidazo[1,2-a]pyridine;2-propan-2-ylimidazo[1,2-a]pyrimidine;6-propan-2-ylimidazo[2,1-b][1,3]thiazole;3-propan-2-yl-1,2,5-oxadiazole;3-propan-2-ylpyridazine;2-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;3-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole is sourced from PubChem (CID 158552798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).