6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-[5-[(4-pyridin-2-ylpyrimidin-2-yl)amino]-1H-indol-2-yl]methanone

C24H20N8O — CID 71233711

IUPAC6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-[5-[(4-pyridin-2-ylpyrimidin-2-yl)amino]-1H-indol-2-yl]methanone
SMILESO=C(c1cc2cc(Nc3nccc(-c4ccccn4)n3)ccc2[nH]1)N1CCn2ccnc2C1
InChIInChI=1S/C24H20N8O/c33-23(32-12-11-31-10-9-26-22(31)15-32)21-14-16-13-17(4-5-18(16)29-21)28-24-27-8-6-20(30-24)19-3-1-2-7-25-19/h1-10,13-14,29H,11-12,15H2,(H,27,28,30)
InChIKeyLEQIJILPHIXTSC-UHFFFAOYSA-N
MW436.48 g/mol
LogP3.62
Rot. Bonds4

About 6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-[5-[(4-pyridin-2-ylpyrimidin-2-yl)amino]-1H-indol-2-yl]methanone

6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-[5-[(4-pyridin-2-ylpyrimidin-2-yl)amino]-1H-indol-2-yl]methanone (PubChem CID 71233711) has the molecular formula C24H20N8O and a molecular weight of 436.48 g/mol. Its IUPAC name is 6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-[5-[(4-pyridin-2-ylpyrimidin-2-yl)amino]-1H-indol-2-yl]methanone.

Molecular Properties

Compound Name6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-[5-[(4-pyridin-2-ylpyrimidin-2-yl)amino]-1H-indol-2-yl]methanone
PubChem CID71233711
Molecular FormulaC24H20N8O
Molecular Weight436.48 g/mol
Exact Mass436.18
IUPAC Name6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-[5-[(4-pyridin-2-ylpyrimidin-2-yl)amino]-1H-indol-2-yl]methanone
SMILESO=C(c1cc2cc(Nc3nccc(-c4ccccn4)n3)ccc2[nH]1)N1CCn2ccnc2C1
InChIInChI=1S/C24H20N8O/c33-23(32-12-11-31-10-9-26-22(31)15-32)21-14-16-13-17(4-5-18(16)29-21)28-24-27-8-6-20(30-24)19-3-1-2-7-25-19/h1-10,13-14,29H,11-12,15H2,(H,27,28,30)
InChIKeyLEQIJILPHIXTSC-UHFFFAOYSA-N
XLogP3.62
TPSA104.62 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500436.48
LogP ≤ 53.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-[5-[(4-pyridin-2-ylpyrimidin-2-yl)amino]-1H-indol-2-yl]methanone with MolForge

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Frequently Asked Questions

What is the IUPAC name of 6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-[5-[(4-pyridin-2-ylpyrimidin-2-yl)amino]-1H-indol-2-yl]methanone?
The IUPAC name of 6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-[5-[(4-pyridin-2-ylpyrimidin-2-yl)amino]-1H-indol-2-yl]methanone (CID 71233711) is 6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-[5-[(4-pyridin-2-ylpyrimidin-2-yl)amino]-1H-indol-2-yl]methanone.
What is the SMILES notation for 6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-[5-[(4-pyridin-2-ylpyrimidin-2-yl)amino]-1H-indol-2-yl]methanone?
The canonical SMILES for 6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-[5-[(4-pyridin-2-ylpyrimidin-2-yl)amino]-1H-indol-2-yl]methanone is O=C(c1cc2cc(Nc3nccc(-c4ccccn4)n3)ccc2[nH]1)N1CCn2ccnc2C1.
What is the InChIKey of 6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-[5-[(4-pyridin-2-ylpyrimidin-2-yl)amino]-1H-indol-2-yl]methanone?
The InChIKey is LEQIJILPHIXTSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20N8O/c33-23(32-12-11-31-10-9-26-22(31)15-32)21-14-16-13-17(4-5-18(16)29-21)28-24-27-8-6-20(30-24)19-3-1-2-7-25-19/h1-10,13-14,29H,11-12,15H2,(H,27,28,30).
What are the key properties of 6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-[5-[(4-pyridin-2-ylpyrimidin-2-yl)amino]-1H-indol-2-yl]methanone?
6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-[5-[(4-pyridin-2-ylpyrimidin-2-yl)amino]-1H-indol-2-yl]methanone has a molecular weight of 436.48 g/mol, XLogP of 3.62, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-[5-[(4-pyridin-2-ylpyrimidin-2-yl)amino]-1H-indol-2-yl]methanone is sourced from PubChem (CID 71233711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).