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1-methyl-4-[5-[4-(2-oxopyrrolidin-1-yl)phenyl]-3-pyridinyl]-6H-pyrazolo[5,4-c]pyridin-7-one

C22H19N5O2 — CID 155210783

Data last refreshed: (MolForge compound catalog, from PubChem)

IUPAC1-methyl-4-[5-[4-(2-oxopyrrolidin-1-yl)phenyl]-3-pyridinyl]-6H-pyrazolo[5,4-c]pyridin-7-one
SMILESCn1ncc2c(-c3cncc(-c4ccc(N5CCCC5=O)cc4)c3)c[nH]c(=O)c21
InChIInChI=1S/C22H19N5O2/c1-26-21-19(13-25-26)18(12-24-22(21)29)16-9-15(10-23-11-16)14-4-6-17(7-5-14)27-8-2-3-20(27)28/h4-7,9-13H,2-3,8H2,1H3,(H,24,29)
InChIKeyBZOZGROBSXLNTO-UHFFFAOYSA-N
MW385.43 g/mol
LogP3.12
Rot. Bonds3

About 1-methyl-4-[5-[4-(2-oxopyrrolidin-1-yl)phenyl]-3-pyridinyl]-6H-pyrazolo[5,4-c]pyridin-7-one

1-methyl-4-[5-[4-(2-oxopyrrolidin-1-yl)phenyl]-3-pyridinyl]-6H-pyrazolo[5,4-c]pyridin-7-one (PubChem CID 155210783) has the molecular formula C22H19N5O2 and a molecular weight of 385.43 g/mol. Its IUPAC name is 1-methyl-4-[5-[4-(2-oxopyrrolidin-1-yl)phenyl]-3-pyridinyl]-6H-pyrazolo[5,4-c]pyridin-7-one.

Molecular Properties

Compound Name1-methyl-4-[5-[4-(2-oxopyrrolidin-1-yl)phenyl]-3-pyridinyl]-6H-pyrazolo[5,4-c]pyridin-7-one
PubChem CID155210783
Molecular FormulaC22H19N5O2
Molecular Weight385.43 g/mol
Exact Mass385.15
IUPAC Name1-methyl-4-[5-[4-(2-oxopyrrolidin-1-yl)phenyl]-3-pyridinyl]-6H-pyrazolo[5,4-c]pyridin-7-one
SMILESCn1ncc2c(-c3cncc(-c4ccc(N5CCCC5=O)cc4)c3)c[nH]c(=O)c21
InChIInChI=1S/C22H19N5O2/c1-26-21-19(13-25-26)18(12-24-22(21)29)16-9-15(10-23-11-16)14-4-6-17(7-5-14)27-8-2-3-20(27)28/h4-7,9-13H,2-3,8H2,1H3,(H,24,29)
InChIKeyBZOZGROBSXLNTO-UHFFFAOYSA-N
XLogP3.12
TPSA83.88 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.43
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-4-[5-[4-(2-oxopyrrolidin-1-yl)phenyl]-3-pyridinyl]-6H-pyrazolo[5,4-c]pyridin-7-one?
The IUPAC name of 1-methyl-4-[5-[4-(2-oxopyrrolidin-1-yl)phenyl]-3-pyridinyl]-6H-pyrazolo[5,4-c]pyridin-7-one (CID 155210783) is 1-methyl-4-[5-[4-(2-oxopyrrolidin-1-yl)phenyl]-3-pyridinyl]-6H-pyrazolo[5,4-c]pyridin-7-one.
What is the SMILES notation for 1-methyl-4-[5-[4-(2-oxopyrrolidin-1-yl)phenyl]-3-pyridinyl]-6H-pyrazolo[5,4-c]pyridin-7-one?
The canonical SMILES for 1-methyl-4-[5-[4-(2-oxopyrrolidin-1-yl)phenyl]-3-pyridinyl]-6H-pyrazolo[5,4-c]pyridin-7-one is Cn1ncc2c(-c3cncc(-c4ccc(N5CCCC5=O)cc4)c3)c[nH]c(=O)c21.
What is the InChIKey of 1-methyl-4-[5-[4-(2-oxopyrrolidin-1-yl)phenyl]-3-pyridinyl]-6H-pyrazolo[5,4-c]pyridin-7-one?
The InChIKey is BZOZGROBSXLNTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N5O2/c1-26-21-19(13-25-26)18(12-24-22(21)29)16-9-15(10-23-11-16)14-4-6-17(7-5-14)27-8-2-3-20(27)28/h4-7,9-13H,2-3,8H2,1H3,(H,24,29).
What are the key properties of 1-methyl-4-[5-[4-(2-oxopyrrolidin-1-yl)phenyl]-3-pyridinyl]-6H-pyrazolo[5,4-c]pyridin-7-one?
1-methyl-4-[5-[4-(2-oxopyrrolidin-1-yl)phenyl]-3-pyridinyl]-6H-pyrazolo[5,4-c]pyridin-7-one has a molecular weight of 385.43 g/mol, XLogP of 3.12, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-[5-[4-(2-oxopyrrolidin-1-yl)phenyl]-3-pyridinyl]-6H-pyrazolo[5,4-c]pyridin-7-one is sourced from PubChem (CID 155210783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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