N-[2-[1-(1H-pyrazolo[5,4-d]pyrimidin-4-yl)-2,3-dihydroindol-3-yl]ethyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-7-carboxamide

C23H24N8O — CID 166271726

IUPACN-[2-[1-(1H-pyrazolo[5,4-d]pyrimidin-4-yl)-2,3-dihydroindol-3-yl]ethyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-7-carboxamide
SMILESO=C(NCCC1CN(c2ncnc3[nH]ncc23)c2ccccc21)C1CCn2ccnc2C1
InChIInChI=1S/C23H24N8O/c32-23(15-6-9-30-10-8-24-20(30)11-15)25-7-5-16-13-31(19-4-2-1-3-17(16)19)22-18-12-28-29-21(18)26-14-27-22/h1-4,8,10,12,14-16H,5-7,9,11,13H2,(H,25,32)(H,26,27,28,29)
InChIKeyPKPOPWUIBSOGIS-UHFFFAOYSA-N
MW428.50 g/mol
LogP2.55
Rot. Bonds5

About N-[2-[1-(1H-pyrazolo[5,4-d]pyrimidin-4-yl)-2,3-dihydroindol-3-yl]ethyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-7-carboxamide

N-[2-[1-(1H-pyrazolo[5,4-d]pyrimidin-4-yl)-2,3-dihydroindol-3-yl]ethyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-7-carboxamide (PubChem CID 166271726) has the molecular formula C23H24N8O and a molecular weight of 428.50 g/mol. Its IUPAC name is N-[2-[1-(1H-pyrazolo[5,4-d]pyrimidin-4-yl)-2,3-dihydroindol-3-yl]ethyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-7-carboxamide.

Molecular Properties

Compound NameN-[2-[1-(1H-pyrazolo[5,4-d]pyrimidin-4-yl)-2,3-dihydroindol-3-yl]ethyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-7-carboxamide
PubChem CID166271726
Molecular FormulaC23H24N8O
Molecular Weight428.50 g/mol
Exact Mass428.21
IUPAC NameN-[2-[1-(1H-pyrazolo[5,4-d]pyrimidin-4-yl)-2,3-dihydroindol-3-yl]ethyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-7-carboxamide
SMILESO=C(NCCC1CN(c2ncnc3[nH]ncc23)c2ccccc21)C1CCn2ccnc2C1
InChIInChI=1S/C23H24N8O/c32-23(15-6-9-30-10-8-24-20(30)11-15)25-7-5-16-13-31(19-4-2-1-3-17(16)19)22-18-12-28-29-21(18)26-14-27-22/h1-4,8,10,12,14-16H,5-7,9,11,13H2,(H,25,32)(H,26,27,28,29)
InChIKeyPKPOPWUIBSOGIS-UHFFFAOYSA-N
XLogP2.55
TPSA104.62 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500428.50
LogP ≤ 52.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze N-[2-[1-(1H-pyrazolo[5,4-d]pyrimidin-4-yl)-2,3-dihydroindol-3-yl]ethyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-7-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[2-[1-(1H-pyrazolo[5,4-d]pyrimidin-4-yl)-2,3-dihydroindol-3-yl]ethyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-7-carboxamide?
The IUPAC name of N-[2-[1-(1H-pyrazolo[5,4-d]pyrimidin-4-yl)-2,3-dihydroindol-3-yl]ethyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-7-carboxamide (CID 166271726) is N-[2-[1-(1H-pyrazolo[5,4-d]pyrimidin-4-yl)-2,3-dihydroindol-3-yl]ethyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-7-carboxamide.
What is the SMILES notation for N-[2-[1-(1H-pyrazolo[5,4-d]pyrimidin-4-yl)-2,3-dihydroindol-3-yl]ethyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-7-carboxamide?
The canonical SMILES for N-[2-[1-(1H-pyrazolo[5,4-d]pyrimidin-4-yl)-2,3-dihydroindol-3-yl]ethyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-7-carboxamide is O=C(NCCC1CN(c2ncnc3[nH]ncc23)c2ccccc21)C1CCn2ccnc2C1.
What is the InChIKey of N-[2-[1-(1H-pyrazolo[5,4-d]pyrimidin-4-yl)-2,3-dihydroindol-3-yl]ethyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-7-carboxamide?
The InChIKey is PKPOPWUIBSOGIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N8O/c32-23(15-6-9-30-10-8-24-20(30)11-15)25-7-5-16-13-31(19-4-2-1-3-17(16)19)22-18-12-28-29-21(18)26-14-27-22/h1-4,8,10,12,14-16H,5-7,9,11,13H2,(H,25,32)(H,26,27,28,29).
What are the key properties of N-[2-[1-(1H-pyrazolo[5,4-d]pyrimidin-4-yl)-2,3-dihydroindol-3-yl]ethyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-7-carboxamide?
N-[2-[1-(1H-pyrazolo[5,4-d]pyrimidin-4-yl)-2,3-dihydroindol-3-yl]ethyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-7-carboxamide has a molecular weight of 428.50 g/mol, XLogP of 2.55, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[1-(1H-pyrazolo[5,4-d]pyrimidin-4-yl)-2,3-dihydroindol-3-yl]ethyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-7-carboxamide is sourced from PubChem (CID 166271726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).