2-[2-[cyclopropyl(hydroxy)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-1-(2,3-dihydroindol-1-yl)ethanone

C20H24N4O2 — CID 91765693

IUPAC2-[2-[cyclopropyl(hydroxy)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-1-(2,3-dihydroindol-1-yl)ethanone
SMILESO=C(CN1CCn2nc(C(O)C3CC3)cc2C1)N1CCc2ccccc21
InChIInChI=1S/C20H24N4O2/c25-19(23-8-7-14-3-1-2-4-18(14)23)13-22-9-10-24-16(12-22)11-17(21-24)20(26)15-5-6-15/h1-4,11,15,20,26H,5-10,12-13H2
InChIKeyPXLZTTINVQWUCS-UHFFFAOYSA-N
MW352.44 g/mol
LogP1.73
Rot. Bonds4

About 2-[2-[cyclopropyl(hydroxy)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-1-(2,3-dihydroindol-1-yl)ethanone

2-[2-[cyclopropyl(hydroxy)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-1-(2,3-dihydroindol-1-yl)ethanone (PubChem CID 91765693) has the molecular formula C20H24N4O2 and a molecular weight of 352.44 g/mol. Its IUPAC name is 2-[2-[cyclopropyl(hydroxy)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-1-(2,3-dihydroindol-1-yl)ethanone.

Molecular Properties

Compound Name2-[2-[cyclopropyl(hydroxy)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-1-(2,3-dihydroindol-1-yl)ethanone
PubChem CID91765693
Molecular FormulaC20H24N4O2
Molecular Weight352.44 g/mol
Exact Mass352.19
IUPAC Name2-[2-[cyclopropyl(hydroxy)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-1-(2,3-dihydroindol-1-yl)ethanone
SMILESO=C(CN1CCn2nc(C(O)C3CC3)cc2C1)N1CCc2ccccc21
InChIInChI=1S/C20H24N4O2/c25-19(23-8-7-14-3-1-2-4-18(14)23)13-22-9-10-24-16(12-22)11-17(21-24)20(26)15-5-6-15/h1-4,11,15,20,26H,5-10,12-13H2
InChIKeyPXLZTTINVQWUCS-UHFFFAOYSA-N
XLogP1.73
TPSA61.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.44
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[2-[cyclopropyl(hydroxy)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-1-(2,3-dihydroindol-1-yl)ethanone?
The IUPAC name of 2-[2-[cyclopropyl(hydroxy)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-1-(2,3-dihydroindol-1-yl)ethanone (CID 91765693) is 2-[2-[cyclopropyl(hydroxy)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-1-(2,3-dihydroindol-1-yl)ethanone.
What is the SMILES notation for 2-[2-[cyclopropyl(hydroxy)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-1-(2,3-dihydroindol-1-yl)ethanone?
The canonical SMILES for 2-[2-[cyclopropyl(hydroxy)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-1-(2,3-dihydroindol-1-yl)ethanone is O=C(CN1CCn2nc(C(O)C3CC3)cc2C1)N1CCc2ccccc21.
What is the InChIKey of 2-[2-[cyclopropyl(hydroxy)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-1-(2,3-dihydroindol-1-yl)ethanone?
The InChIKey is PXLZTTINVQWUCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N4O2/c25-19(23-8-7-14-3-1-2-4-18(14)23)13-22-9-10-24-16(12-22)11-17(21-24)20(26)15-5-6-15/h1-4,11,15,20,26H,5-10,12-13H2.
What are the key properties of 2-[2-[cyclopropyl(hydroxy)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-1-(2,3-dihydroindol-1-yl)ethanone?
2-[2-[cyclopropyl(hydroxy)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-1-(2,3-dihydroindol-1-yl)ethanone has a molecular weight of 352.44 g/mol, XLogP of 1.73, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[cyclopropyl(hydroxy)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-1-(2,3-dihydroindol-1-yl)ethanone is sourced from PubChem (CID 91765693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).