2,4-dimethyl-N-(2-oxo-1,3-dihydroindol-5-yl)imidazo[1,5-a]pyrimidine-8-carboxamide

C17H15N5O2 — CID 121328769

IUPAC2,4-dimethyl-N-(2-oxo-1,3-dihydroindol-5-yl)imidazo[1,5-a]pyrimidine-8-carboxamide
SMILESCc1cc(C)n2cnc(C(=O)Nc3ccc4c(c3)CC(=O)N4)c2n1
InChIInChI=1S/C17H15N5O2/c1-9-5-10(2)22-8-18-15(16(22)19-9)17(24)20-12-3-4-13-11(6-12)7-14(23)21-13/h3-6,8H,7H2,1-2H3,(H,20,24)(H,21,23)
InChIKeyUKEISXIXHMVECQ-UHFFFAOYSA-N
MW321.34 g/mol
LogP2.09
Rot. Bonds2

About 2,4-dimethyl-N-(2-oxo-1,3-dihydroindol-5-yl)imidazo[1,5-a]pyrimidine-8-carboxamide

2,4-dimethyl-N-(2-oxo-1,3-dihydroindol-5-yl)imidazo[1,5-a]pyrimidine-8-carboxamide (PubChem CID 121328769) has the molecular formula C17H15N5O2 and a molecular weight of 321.34 g/mol. Its IUPAC name is 2,4-dimethyl-N-(2-oxo-1,3-dihydroindol-5-yl)imidazo[1,5-a]pyrimidine-8-carboxamide.

Molecular Properties

Compound Name2,4-dimethyl-N-(2-oxo-1,3-dihydroindol-5-yl)imidazo[1,5-a]pyrimidine-8-carboxamide
PubChem CID121328769
Molecular FormulaC17H15N5O2
Molecular Weight321.34 g/mol
Exact Mass321.12
IUPAC Name2,4-dimethyl-N-(2-oxo-1,3-dihydroindol-5-yl)imidazo[1,5-a]pyrimidine-8-carboxamide
SMILESCc1cc(C)n2cnc(C(=O)Nc3ccc4c(c3)CC(=O)N4)c2n1
InChIInChI=1S/C17H15N5O2/c1-9-5-10(2)22-8-18-15(16(22)19-9)17(24)20-12-3-4-13-11(6-12)7-14(23)21-13/h3-6,8H,7H2,1-2H3,(H,20,24)(H,21,23)
InChIKeyUKEISXIXHMVECQ-UHFFFAOYSA-N
XLogP2.09
TPSA88.39 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.34
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-N-(2-oxo-1,3-dihydroindol-5-yl)imidazo[1,5-a]pyrimidine-8-carboxamide?
The IUPAC name of 2,4-dimethyl-N-(2-oxo-1,3-dihydroindol-5-yl)imidazo[1,5-a]pyrimidine-8-carboxamide (CID 121328769) is 2,4-dimethyl-N-(2-oxo-1,3-dihydroindol-5-yl)imidazo[1,5-a]pyrimidine-8-carboxamide.
What is the SMILES notation for 2,4-dimethyl-N-(2-oxo-1,3-dihydroindol-5-yl)imidazo[1,5-a]pyrimidine-8-carboxamide?
The canonical SMILES for 2,4-dimethyl-N-(2-oxo-1,3-dihydroindol-5-yl)imidazo[1,5-a]pyrimidine-8-carboxamide is Cc1cc(C)n2cnc(C(=O)Nc3ccc4c(c3)CC(=O)N4)c2n1.
What is the InChIKey of 2,4-dimethyl-N-(2-oxo-1,3-dihydroindol-5-yl)imidazo[1,5-a]pyrimidine-8-carboxamide?
The InChIKey is UKEISXIXHMVECQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N5O2/c1-9-5-10(2)22-8-18-15(16(22)19-9)17(24)20-12-3-4-13-11(6-12)7-14(23)21-13/h3-6,8H,7H2,1-2H3,(H,20,24)(H,21,23).
What are the key properties of 2,4-dimethyl-N-(2-oxo-1,3-dihydroindol-5-yl)imidazo[1,5-a]pyrimidine-8-carboxamide?
2,4-dimethyl-N-(2-oxo-1,3-dihydroindol-5-yl)imidazo[1,5-a]pyrimidine-8-carboxamide has a molecular weight of 321.34 g/mol, XLogP of 2.09, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-N-(2-oxo-1,3-dihydroindol-5-yl)imidazo[1,5-a]pyrimidine-8-carboxamide is sourced from PubChem (CID 121328769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).