7-(1-methylpyrazolo[4,5-b]pyridin-6-yl)-2H-pyrrolo[1,2-a]pyrazin-1-one

C14H11N5O — CID 167835672

IUPAC7-(1-methylpyrazolo[4,5-b]pyridin-6-yl)-2H-pyrrolo[1,2-a]pyrazin-1-one
SMILESCn1ncc2ncc(-c3cc4c(=O)[nH]ccn4c3)cc21
InChIInChI=1S/C14H11N5O/c1-18-12-4-9(6-16-11(12)7-17-18)10-5-13-14(20)15-2-3-19(13)8-10/h2-8H,1H3,(H,15,20)
InChIKeyWAQQYJDOEFGTSU-UHFFFAOYSA-N
MW265.28 g/mol
LogP1.58
Rot. Bonds1

About 7-(1-methylpyrazolo[4,5-b]pyridin-6-yl)-2H-pyrrolo[1,2-a]pyrazin-1-one

7-(1-methylpyrazolo[4,5-b]pyridin-6-yl)-2H-pyrrolo[1,2-a]pyrazin-1-one (PubChem CID 167835672) has the molecular formula C14H11N5O and a molecular weight of 265.28 g/mol. Its IUPAC name is 7-(1-methylpyrazolo[4,5-b]pyridin-6-yl)-2H-pyrrolo[1,2-a]pyrazin-1-one.

Molecular Properties

Compound Name7-(1-methylpyrazolo[4,5-b]pyridin-6-yl)-2H-pyrrolo[1,2-a]pyrazin-1-one
PubChem CID167835672
Molecular FormulaC14H11N5O
Molecular Weight265.28 g/mol
Exact Mass265.10
IUPAC Name7-(1-methylpyrazolo[4,5-b]pyridin-6-yl)-2H-pyrrolo[1,2-a]pyrazin-1-one
SMILESCn1ncc2ncc(-c3cc4c(=O)[nH]ccn4c3)cc21
InChIInChI=1S/C14H11N5O/c1-18-12-4-9(6-16-11(12)7-17-18)10-5-13-14(20)15-2-3-19(13)8-10/h2-8H,1H3,(H,15,20)
InChIKeyWAQQYJDOEFGTSU-UHFFFAOYSA-N
XLogP1.58
TPSA67.98 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.28
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 7-(1-methylpyrazolo[4,5-b]pyridin-6-yl)-2H-pyrrolo[1,2-a]pyrazin-1-one?
The IUPAC name of 7-(1-methylpyrazolo[4,5-b]pyridin-6-yl)-2H-pyrrolo[1,2-a]pyrazin-1-one (CID 167835672) is 7-(1-methylpyrazolo[4,5-b]pyridin-6-yl)-2H-pyrrolo[1,2-a]pyrazin-1-one.
What is the SMILES notation for 7-(1-methylpyrazolo[4,5-b]pyridin-6-yl)-2H-pyrrolo[1,2-a]pyrazin-1-one?
The canonical SMILES for 7-(1-methylpyrazolo[4,5-b]pyridin-6-yl)-2H-pyrrolo[1,2-a]pyrazin-1-one is Cn1ncc2ncc(-c3cc4c(=O)[nH]ccn4c3)cc21.
What is the InChIKey of 7-(1-methylpyrazolo[4,5-b]pyridin-6-yl)-2H-pyrrolo[1,2-a]pyrazin-1-one?
The InChIKey is WAQQYJDOEFGTSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N5O/c1-18-12-4-9(6-16-11(12)7-17-18)10-5-13-14(20)15-2-3-19(13)8-10/h2-8H,1H3,(H,15,20).
What are the key properties of 7-(1-methylpyrazolo[4,5-b]pyridin-6-yl)-2H-pyrrolo[1,2-a]pyrazin-1-one?
7-(1-methylpyrazolo[4,5-b]pyridin-6-yl)-2H-pyrrolo[1,2-a]pyrazin-1-one has a molecular weight of 265.28 g/mol, XLogP of 1.58, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(1-methylpyrazolo[4,5-b]pyridin-6-yl)-2H-pyrrolo[1,2-a]pyrazin-1-one is sourced from PubChem (CID 167835672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).