5-(5-methyl-7-morpholin-4-yl-2-phenylpyrazolo[1,5-c]pyrimidin-3-yl)-1,3-dihydroindol-2-one

C25H23N5O2 — CID 122655829

IUPAC5-(5-methyl-7-morpholin-4-yl-2-phenylpyrazolo[1,5-c]pyrimidin-3-yl)-1,3-dihydroindol-2-one
SMILESCc1cc2c(-c3ccc4c(c3)CC(=O)N4)c(-c3ccccc3)nn2c(N2CCOCC2)n1
InChIInChI=1S/C25H23N5O2/c1-16-13-21-23(18-7-8-20-19(14-18)15-22(31)27-20)24(17-5-3-2-4-6-17)28-30(21)25(26-16)29-9-11-32-12-10-29/h2-8,13-14H,9-12,15H2,1H3,(H,27,31)
InChIKeyYPBKJAKDLXKIMK-UHFFFAOYSA-N
MW425.49 g/mol
LogP3.70
Rot. Bonds3

About 5-(5-methyl-7-morpholin-4-yl-2-phenylpyrazolo[1,5-c]pyrimidin-3-yl)-1,3-dihydroindol-2-one

5-(5-methyl-7-morpholin-4-yl-2-phenylpyrazolo[1,5-c]pyrimidin-3-yl)-1,3-dihydroindol-2-one (PubChem CID 122655829) has the molecular formula C25H23N5O2 and a molecular weight of 425.49 g/mol. Its IUPAC name is 5-(5-methyl-7-morpholin-4-yl-2-phenylpyrazolo[1,5-c]pyrimidin-3-yl)-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name5-(5-methyl-7-morpholin-4-yl-2-phenylpyrazolo[1,5-c]pyrimidin-3-yl)-1,3-dihydroindol-2-one
PubChem CID122655829
Molecular FormulaC25H23N5O2
Molecular Weight425.49 g/mol
Exact Mass425.19
IUPAC Name5-(5-methyl-7-morpholin-4-yl-2-phenylpyrazolo[1,5-c]pyrimidin-3-yl)-1,3-dihydroindol-2-one
SMILESCc1cc2c(-c3ccc4c(c3)CC(=O)N4)c(-c3ccccc3)nn2c(N2CCOCC2)n1
InChIInChI=1S/C25H23N5O2/c1-16-13-21-23(18-7-8-20-19(14-18)15-22(31)27-20)24(17-5-3-2-4-6-17)28-30(21)25(26-16)29-9-11-32-12-10-29/h2-8,13-14H,9-12,15H2,1H3,(H,27,31)
InChIKeyYPBKJAKDLXKIMK-UHFFFAOYSA-N
XLogP3.70
TPSA71.76 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500425.49
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-(5-methyl-7-morpholin-4-yl-2-phenylpyrazolo[1,5-c]pyrimidin-3-yl)-1,3-dihydroindol-2-one?
The IUPAC name of 5-(5-methyl-7-morpholin-4-yl-2-phenylpyrazolo[1,5-c]pyrimidin-3-yl)-1,3-dihydroindol-2-one (CID 122655829) is 5-(5-methyl-7-morpholin-4-yl-2-phenylpyrazolo[1,5-c]pyrimidin-3-yl)-1,3-dihydroindol-2-one.
What is the SMILES notation for 5-(5-methyl-7-morpholin-4-yl-2-phenylpyrazolo[1,5-c]pyrimidin-3-yl)-1,3-dihydroindol-2-one?
The canonical SMILES for 5-(5-methyl-7-morpholin-4-yl-2-phenylpyrazolo[1,5-c]pyrimidin-3-yl)-1,3-dihydroindol-2-one is Cc1cc2c(-c3ccc4c(c3)CC(=O)N4)c(-c3ccccc3)nn2c(N2CCOCC2)n1.
What is the InChIKey of 5-(5-methyl-7-morpholin-4-yl-2-phenylpyrazolo[1,5-c]pyrimidin-3-yl)-1,3-dihydroindol-2-one?
The InChIKey is YPBKJAKDLXKIMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H23N5O2/c1-16-13-21-23(18-7-8-20-19(14-18)15-22(31)27-20)24(17-5-3-2-4-6-17)28-30(21)25(26-16)29-9-11-32-12-10-29/h2-8,13-14H,9-12,15H2,1H3,(H,27,31).
What are the key properties of 5-(5-methyl-7-morpholin-4-yl-2-phenylpyrazolo[1,5-c]pyrimidin-3-yl)-1,3-dihydroindol-2-one?
5-(5-methyl-7-morpholin-4-yl-2-phenylpyrazolo[1,5-c]pyrimidin-3-yl)-1,3-dihydroindol-2-one has a molecular weight of 425.49 g/mol, XLogP of 3.70, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(5-methyl-7-morpholin-4-yl-2-phenylpyrazolo[1,5-c]pyrimidin-3-yl)-1,3-dihydroindol-2-one is sourced from PubChem (CID 122655829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).