1-[1-[6-methyl-1-(2-methyl-4-pyrazol-1-ylphenyl)-2,3-dihydropyrrolo[2,3-b]pyridin-4-yl]pyrazol-3-yl]imidazolidin-2-one

C24H24N8O — CID 11751039

IUPAC1-[1-[6-methyl-1-(2-methyl-4-pyrazol-1-ylphenyl)-2,3-dihydropyrrolo[2,3-b]pyridin-4-yl]pyrazol-3-yl]imidazolidin-2-one
SMILESCc1cc(-n2ccc(N3CCNC3=O)n2)c2c(n1)N(c1ccc(-n3cccn3)cc1C)CC2
InChIInChI=1S/C24H24N8O/c1-16-14-18(31-10-3-8-26-31)4-5-20(16)29-11-6-19-21(15-17(2)27-23(19)29)32-12-7-22(28-32)30-13-9-25-24(30)33/h3-5,7-8,10,12,14-15H,6,9,11,13H2,1-2H3,(H,25,33)
InChIKeyFINIAPHFAQDCHV-UHFFFAOYSA-N
MW440.51 g/mol
LogP3.29
Rot. Bonds4

About 1-[1-[6-methyl-1-(2-methyl-4-pyrazol-1-ylphenyl)-2,3-dihydropyrrolo[2,3-b]pyridin-4-yl]pyrazol-3-yl]imidazolidin-2-one

1-[1-[6-methyl-1-(2-methyl-4-pyrazol-1-ylphenyl)-2,3-dihydropyrrolo[2,3-b]pyridin-4-yl]pyrazol-3-yl]imidazolidin-2-one (PubChem CID 11751039) has the molecular formula C24H24N8O and a molecular weight of 440.51 g/mol. Its IUPAC name is 1-[1-[6-methyl-1-(2-methyl-4-pyrazol-1-ylphenyl)-2,3-dihydropyrrolo[2,3-b]pyridin-4-yl]pyrazol-3-yl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[1-[6-methyl-1-(2-methyl-4-pyrazol-1-ylphenyl)-2,3-dihydropyrrolo[2,3-b]pyridin-4-yl]pyrazol-3-yl]imidazolidin-2-one
PubChem CID11751039
Molecular FormulaC24H24N8O
Molecular Weight440.51 g/mol
Exact Mass440.21
IUPAC Name1-[1-[6-methyl-1-(2-methyl-4-pyrazol-1-ylphenyl)-2,3-dihydropyrrolo[2,3-b]pyridin-4-yl]pyrazol-3-yl]imidazolidin-2-one
SMILESCc1cc(-n2ccc(N3CCNC3=O)n2)c2c(n1)N(c1ccc(-n3cccn3)cc1C)CC2
InChIInChI=1S/C24H24N8O/c1-16-14-18(31-10-3-8-26-31)4-5-20(16)29-11-6-19-21(15-17(2)27-23(19)29)32-12-7-22(28-32)30-13-9-25-24(30)33/h3-5,7-8,10,12,14-15H,6,9,11,13H2,1-2H3,(H,25,33)
InChIKeyFINIAPHFAQDCHV-UHFFFAOYSA-N
XLogP3.29
TPSA84.11 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500440.51
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 1-[1-[6-methyl-1-(2-methyl-4-pyrazol-1-ylphenyl)-2,3-dihydropyrrolo[2,3-b]pyridin-4-yl]pyrazol-3-yl]imidazolidin-2-one with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-[1-[6-methyl-1-(2-methyl-4-pyrazol-1-ylphenyl)-2,3-dihydropyrrolo[2,3-b]pyridin-4-yl]pyrazol-3-yl]imidazolidin-2-one?
The IUPAC name of 1-[1-[6-methyl-1-(2-methyl-4-pyrazol-1-ylphenyl)-2,3-dihydropyrrolo[2,3-b]pyridin-4-yl]pyrazol-3-yl]imidazolidin-2-one (CID 11751039) is 1-[1-[6-methyl-1-(2-methyl-4-pyrazol-1-ylphenyl)-2,3-dihydropyrrolo[2,3-b]pyridin-4-yl]pyrazol-3-yl]imidazolidin-2-one.
What is the SMILES notation for 1-[1-[6-methyl-1-(2-methyl-4-pyrazol-1-ylphenyl)-2,3-dihydropyrrolo[2,3-b]pyridin-4-yl]pyrazol-3-yl]imidazolidin-2-one?
The canonical SMILES for 1-[1-[6-methyl-1-(2-methyl-4-pyrazol-1-ylphenyl)-2,3-dihydropyrrolo[2,3-b]pyridin-4-yl]pyrazol-3-yl]imidazolidin-2-one is Cc1cc(-n2ccc(N3CCNC3=O)n2)c2c(n1)N(c1ccc(-n3cccn3)cc1C)CC2.
What is the InChIKey of 1-[1-[6-methyl-1-(2-methyl-4-pyrazol-1-ylphenyl)-2,3-dihydropyrrolo[2,3-b]pyridin-4-yl]pyrazol-3-yl]imidazolidin-2-one?
The InChIKey is FINIAPHFAQDCHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N8O/c1-16-14-18(31-10-3-8-26-31)4-5-20(16)29-11-6-19-21(15-17(2)27-23(19)29)32-12-7-22(28-32)30-13-9-25-24(30)33/h3-5,7-8,10,12,14-15H,6,9,11,13H2,1-2H3,(H,25,33).
What are the key properties of 1-[1-[6-methyl-1-(2-methyl-4-pyrazol-1-ylphenyl)-2,3-dihydropyrrolo[2,3-b]pyridin-4-yl]pyrazol-3-yl]imidazolidin-2-one?
1-[1-[6-methyl-1-(2-methyl-4-pyrazol-1-ylphenyl)-2,3-dihydropyrrolo[2,3-b]pyridin-4-yl]pyrazol-3-yl]imidazolidin-2-one has a molecular weight of 440.51 g/mol, XLogP of 3.29, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[6-methyl-1-(2-methyl-4-pyrazol-1-ylphenyl)-2,3-dihydropyrrolo[2,3-b]pyridin-4-yl]pyrazol-3-yl]imidazolidin-2-one is sourced from PubChem (CID 11751039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).