3-(2,3-dihydro-1H-inden-5-yl)-2-phenyl-5-pyrazol-1-ylimidazo[4,5-b]pyridine;6-methylpyridine-3-carboxamide

C31H27N7O — CID 176699033

IUPAC3-(2,3-dihydro-1H-inden-5-yl)-2-phenyl-5-pyrazol-1-ylimidazo[4,5-b]pyridine;6-methylpyridine-3-carboxamide
SMILESCc1ccc(C(N)=O)cn1.c1ccc(-c2nc3ccc(-n4cccn4)nc3n2-c2ccc3c(c2)CCC3)cc1
InChIInChI=1S/C24H19N5.C7H8N2O/c1-2-6-18(7-3-1)23-26-21-12-13-22(28-15-5-14-25-28)27-24(21)29(23)20-11-10-17-8-4-9-19(17)16-20;1-5-2-3-6(4-9-5)7(8)10/h1-3,5-7,10-16H,4,8-9H2;2-4H,1H3,(H2,8,10)
InChIKeyUNGDSNFYLLITHR-UHFFFAOYSA-N
MW513.61 g/mol
LogP5.25
Rot. Bonds4

About 3-(2,3-dihydro-1H-inden-5-yl)-2-phenyl-5-pyrazol-1-ylimidazo[4,5-b]pyridine;6-methylpyridine-3-carboxamide

3-(2,3-dihydro-1H-inden-5-yl)-2-phenyl-5-pyrazol-1-ylimidazo[4,5-b]pyridine;6-methylpyridine-3-carboxamide (PubChem CID 176699033) has the molecular formula C31H27N7O and a molecular weight of 513.61 g/mol. Its IUPAC name is 3-(2,3-dihydro-1H-inden-5-yl)-2-phenyl-5-pyrazol-1-ylimidazo[4,5-b]pyridine;6-methylpyridine-3-carboxamide.

Molecular Properties

Compound Name3-(2,3-dihydro-1H-inden-5-yl)-2-phenyl-5-pyrazol-1-ylimidazo[4,5-b]pyridine;6-methylpyridine-3-carboxamide
PubChem CID176699033
Molecular FormulaC31H27N7O
Molecular Weight513.61 g/mol
Exact Mass513.23
IUPAC Name3-(2,3-dihydro-1H-inden-5-yl)-2-phenyl-5-pyrazol-1-ylimidazo[4,5-b]pyridine;6-methylpyridine-3-carboxamide
SMILESCc1ccc(C(N)=O)cn1.c1ccc(-c2nc3ccc(-n4cccn4)nc3n2-c2ccc3c(c2)CCC3)cc1
InChIInChI=1S/C24H19N5.C7H8N2O/c1-2-6-18(7-3-1)23-26-21-12-13-22(28-15-5-14-25-28)27-24(21)29(23)20-11-10-17-8-4-9-19(17)16-20;1-5-2-3-6(4-9-5)7(8)10/h1-3,5-7,10-16H,4,8-9H2;2-4H,1H3,(H2,8,10)
InChIKeyUNGDSNFYLLITHR-UHFFFAOYSA-N
XLogP5.25
TPSA104.51 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms39
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500513.61
LogP ≤ 55.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 3-(2,3-dihydro-1H-inden-5-yl)-2-phenyl-5-pyrazol-1-ylimidazo[4,5-b]pyridine;6-methylpyridine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-cyclopropylpyrazole-3-carboxamide;3-[3-(2,3-dihydro-1H-inden-5-yl)-5-pyrazol-1-ylimidazo[4,5-b]pyridin-2-yl]pyridin-2-amine
CID 176699378
6-(difluoromethyl)pyridine-3-carboxamide;3-[3-(2,3-dihydro-1H-inden-5-yl)-5-methylimidazo[4,5-b]pyridin-2-yl]pyridin-2-amine
CID 176699603
3-[3-(2,3-dihydro-1H-inden-5-yl)-5-pyrazol-1-ylimidazo[4,5-b]pyridin-2-yl]pyridin-2-amine;N-[2-(methylaminomethyl)phenyl]prop-2-enamide
CID 176981679
3-[7-bromo-3-(2,3-dihydro-1H-inden-5-yl)-5-pyrazol-1-ylimidazo[4,5-b]pyridin-2-yl]pyridin-2-amine;6-(difluoromethyl)pyridine-3-carboxamide
CID 176699283
3-[3-(2,3-dihydro-1H-inden-5-yl)-5-(3-methylpyrazol-1-yl)imidazo[4,5-b]pyridin-2-yl]pyridin-2-amine
CID 176981789
3-[3-(2,3-dihydro-1H-inden-5-yl)-5-pyrazol-1-ylimidazo[4,5-b]pyridin-2-yl]pyridin-2-amine;1-[6-(methylamino)-2-azaspiro[3.5]nonan-2-yl]prop-2-en-1-one
CID 176981683
3-[3-(2,3-dihydro-1H-inden-5-yl)-5-pyrazol-1-ylimidazo[4,5-b]pyridin-2-yl]pyridin-2-amine;4-(oxetan-3-ylmethylamino)piperidine-1-carbaldehyde;prop-1-ene
CID 176981562
3-[3-[(1S)-1-[(6-methyl-3-pyridinyl)methylamino]-2,3-dihydro-1H-inden-5-yl]-5-pyrazol-1-ylimidazo[4,5-b]pyridin-2-yl]pyridin-2-amine
CID 177272703
3-[3-[(1S)-1-[1-(6-methyl-3-pyridinyl)ethylamino]-2,3-dihydro-1H-inden-5-yl]-5-pyrazol-1-ylimidazo[4,5-b]pyridin-2-yl]pyridin-2-amine
CID 177272588
N-[(1S)-5-[2-(2-amino-3-pyridinyl)-5-pyrazol-1-ylimidazo[4,5-b]pyridin-3-yl]-2,3-dihydro-1H-inden-1-yl]-5-fluoro-6-methoxypyridine-3-carboxamide
CID 176699115
1-[4-[[5-(5-pyrazol-1-yl-2-pyridin-3-ylimidazo[4,5-b]pyridin-3-yl)-2,3-dihydro-1H-inden-1-yl]amino]piperidin-1-yl]prop-2-en-1-one
CID 176982034
3-[3-[(1S)-1-(methylamino)-2,3-dihydro-1H-inden-5-yl]-5-pyrazol-1-ylimidazo[4,5-b]pyridin-2-yl]pyridin-2-amine
CID 177272462

Frequently Asked Questions

What is the IUPAC name of 3-(2,3-dihydro-1H-inden-5-yl)-2-phenyl-5-pyrazol-1-ylimidazo[4,5-b]pyridine;6-methylpyridine-3-carboxamide?
The IUPAC name of 3-(2,3-dihydro-1H-inden-5-yl)-2-phenyl-5-pyrazol-1-ylimidazo[4,5-b]pyridine;6-methylpyridine-3-carboxamide (CID 176699033) is 3-(2,3-dihydro-1H-inden-5-yl)-2-phenyl-5-pyrazol-1-ylimidazo[4,5-b]pyridine;6-methylpyridine-3-carboxamide.
What is the SMILES notation for 3-(2,3-dihydro-1H-inden-5-yl)-2-phenyl-5-pyrazol-1-ylimidazo[4,5-b]pyridine;6-methylpyridine-3-carboxamide?
The canonical SMILES for 3-(2,3-dihydro-1H-inden-5-yl)-2-phenyl-5-pyrazol-1-ylimidazo[4,5-b]pyridine;6-methylpyridine-3-carboxamide is Cc1ccc(C(N)=O)cn1.c1ccc(-c2nc3ccc(-n4cccn4)nc3n2-c2ccc3c(c2)CCC3)cc1.
What is the InChIKey of 3-(2,3-dihydro-1H-inden-5-yl)-2-phenyl-5-pyrazol-1-ylimidazo[4,5-b]pyridine;6-methylpyridine-3-carboxamide?
The InChIKey is UNGDSNFYLLITHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19N5.C7H8N2O/c1-2-6-18(7-3-1)23-26-21-12-13-22(28-15-5-14-25-28)27-24(21)29(23)20-11-10-17-8-4-9-19(17)16-20;1-5-2-3-6(4-9-5)7(8)10/h1-3,5-7,10-16H,4,8-9H2;2-4H,1H3,(H2,8,10).
What are the key properties of 3-(2,3-dihydro-1H-inden-5-yl)-2-phenyl-5-pyrazol-1-ylimidazo[4,5-b]pyridine;6-methylpyridine-3-carboxamide?
3-(2,3-dihydro-1H-inden-5-yl)-2-phenyl-5-pyrazol-1-ylimidazo[4,5-b]pyridine;6-methylpyridine-3-carboxamide has a molecular weight of 513.61 g/mol, XLogP of 5.25, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,3-dihydro-1H-inden-5-yl)-2-phenyl-5-pyrazol-1-ylimidazo[4,5-b]pyridine;6-methylpyridine-3-carboxamide is sourced from PubChem (CID 176699033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).