2-phenyl-4-N-(pyridin-2-ylmethyl)imidazo[1,5-a]pyrimidine-4,8-dicarboxamide

C20H16N6O2 — CID 24631763

IUPAC2-phenyl-4-N-(pyridin-2-ylmethyl)imidazo[1,5-a]pyrimidine-4,8-dicarboxamide
SMILESNC(=O)c1ncn2c(C(=O)NCc3ccccn3)cc(-c3ccccc3)nc12
InChIInChI=1S/C20H16N6O2/c21-18(27)17-19-25-15(13-6-2-1-3-7-13)10-16(26(19)12-24-17)20(28)23-11-14-8-4-5-9-22-14/h1-10,12H,11H2,(H2,21,27)(H,23,28)
InChIKeyNWVFEGYDGWRMMT-UHFFFAOYSA-N
MW372.39 g/mol
LogP1.82
Rot. Bonds5

About 2-phenyl-4-N-(pyridin-2-ylmethyl)imidazo[1,5-a]pyrimidine-4,8-dicarboxamide

2-phenyl-4-N-(pyridin-2-ylmethyl)imidazo[1,5-a]pyrimidine-4,8-dicarboxamide (PubChem CID 24631763) has the molecular formula C20H16N6O2 and a molecular weight of 372.39 g/mol. Its IUPAC name is 2-phenyl-4-N-(pyridin-2-ylmethyl)imidazo[1,5-a]pyrimidine-4,8-dicarboxamide.

Molecular Properties

Compound Name2-phenyl-4-N-(pyridin-2-ylmethyl)imidazo[1,5-a]pyrimidine-4,8-dicarboxamide
PubChem CID24631763
Molecular FormulaC20H16N6O2
Molecular Weight372.39 g/mol
Exact Mass372.13
IUPAC Name2-phenyl-4-N-(pyridin-2-ylmethyl)imidazo[1,5-a]pyrimidine-4,8-dicarboxamide
SMILESNC(=O)c1ncn2c(C(=O)NCc3ccccn3)cc(-c3ccccc3)nc12
InChIInChI=1S/C20H16N6O2/c21-18(27)17-19-25-15(13-6-2-1-3-7-13)10-16(26(19)12-24-17)20(28)23-11-14-8-4-5-9-22-14/h1-10,12H,11H2,(H2,21,27)(H,23,28)
InChIKeyNWVFEGYDGWRMMT-UHFFFAOYSA-N
XLogP1.82
TPSA115.27 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.39
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-phenyl-4-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]imidazo[1,5-a]pyrimidine-4,8-dicarboxamide
CID 24631856
2-phenyl-4-N-(3-phenylmethoxypropyl)imidazo[1,5-a]pyrimidine-4,8-dicarboxamide
CID 24685185
4-N-(3,4-dimethylphenyl)-2-phenylimidazo[1,5-a]pyrimidine-4,8-dicarboxamide
CID 25358211
1,3-dimethyl-6-phenyl-N-(pyridin-2-ylmethyl)pyrazolo[5,4-b]pyridine-4-carboxamide
CID 36714359
4-N-[1-(3-fluoro-4-methoxyphenyl)ethyl]-2-phenylimidazo[1,5-a]pyrimidine-4,8-dicarboxamide
CID 24631830
2-phenyl-N-(pyridin-2-ylmethyl)quinoline-4-carboxamide
CID 757671
3-phenyl-N-(pyridin-2-ylmethyl)benzamide
CID 110724423
6-phenyl-1-propan-2-yl-N-(pyridin-2-ylmethyl)pyrazolo[5,4-b]pyridine-4-carboxamide
CID 27554312
3-(3-methoxyphenyl)-1-(4-methoxyphenyl)-N-(pyridin-2-ylmethyl)pyrazole-5-carboxamide
CID 42755526
1,3-dimethyl-6-phenyl-N-[3-(pyridin-2-ylmethylcarbamoyl)phenyl]pyrazolo[5,4-b]pyridine-4-carboxamide
CID 55783589
2-(4-methylphenyl)-N-(pyridin-2-ylmethyl)quinoline-4-carboxamide
CID 1220288
1-methyl-N-(pyridin-2-ylmethyl)-3-thiophen-2-ylpyrazole-5-carboxamide
CID 42762181

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-4-N-(pyridin-2-ylmethyl)imidazo[1,5-a]pyrimidine-4,8-dicarboxamide?
The IUPAC name of 2-phenyl-4-N-(pyridin-2-ylmethyl)imidazo[1,5-a]pyrimidine-4,8-dicarboxamide (CID 24631763) is 2-phenyl-4-N-(pyridin-2-ylmethyl)imidazo[1,5-a]pyrimidine-4,8-dicarboxamide.
What is the SMILES notation for 2-phenyl-4-N-(pyridin-2-ylmethyl)imidazo[1,5-a]pyrimidine-4,8-dicarboxamide?
The canonical SMILES for 2-phenyl-4-N-(pyridin-2-ylmethyl)imidazo[1,5-a]pyrimidine-4,8-dicarboxamide is NC(=O)c1ncn2c(C(=O)NCc3ccccn3)cc(-c3ccccc3)nc12.
What is the InChIKey of 2-phenyl-4-N-(pyridin-2-ylmethyl)imidazo[1,5-a]pyrimidine-4,8-dicarboxamide?
The InChIKey is NWVFEGYDGWRMMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N6O2/c21-18(27)17-19-25-15(13-6-2-1-3-7-13)10-16(26(19)12-24-17)20(28)23-11-14-8-4-5-9-22-14/h1-10,12H,11H2,(H2,21,27)(H,23,28).
What are the key properties of 2-phenyl-4-N-(pyridin-2-ylmethyl)imidazo[1,5-a]pyrimidine-4,8-dicarboxamide?
2-phenyl-4-N-(pyridin-2-ylmethyl)imidazo[1,5-a]pyrimidine-4,8-dicarboxamide has a molecular weight of 372.39 g/mol, XLogP of 1.82, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-4-N-(pyridin-2-ylmethyl)imidazo[1,5-a]pyrimidine-4,8-dicarboxamide is sourced from PubChem (CID 24631763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).