6-ethyl-5-naphthalen-1-yl-1-phenylpyrazolo[5,4-d]pyrimidin-4-one

C23H18N4O — CID 1204122

IUPAC6-ethyl-5-naphthalen-1-yl-1-phenylpyrazolo[5,4-d]pyrimidin-4-one
SMILESCCc1nc2c(cnn2-c2ccccc2)c(=O)n1-c1cccc2ccccc12
InChIInChI=1S/C23H18N4O/c1-2-21-25-22-19(15-24-27(22)17-11-4-3-5-12-17)23(28)26(21)20-14-8-10-16-9-6-7-13-18(16)20/h3-15H,2H2,1H3
InChIKeyHPJUPNZKCPPXIY-UHFFFAOYSA-N
MW366.42 g/mol
LogP4.29
Rot. Bonds3

About 6-ethyl-5-naphthalen-1-yl-1-phenylpyrazolo[5,4-d]pyrimidin-4-one

6-ethyl-5-naphthalen-1-yl-1-phenylpyrazolo[5,4-d]pyrimidin-4-one (PubChem CID 1204122) has the molecular formula C23H18N4O and a molecular weight of 366.42 g/mol. Its IUPAC name is 6-ethyl-5-naphthalen-1-yl-1-phenylpyrazolo[5,4-d]pyrimidin-4-one.

Molecular Properties

Compound Name6-ethyl-5-naphthalen-1-yl-1-phenylpyrazolo[5,4-d]pyrimidin-4-one
PubChem CID1204122
Molecular FormulaC23H18N4O
Molecular Weight366.42 g/mol
Exact Mass366.15
IUPAC Name6-ethyl-5-naphthalen-1-yl-1-phenylpyrazolo[5,4-d]pyrimidin-4-one
SMILESCCc1nc2c(cnn2-c2ccccc2)c(=O)n1-c1cccc2ccccc12
InChIInChI=1S/C23H18N4O/c1-2-21-25-22-19(15-24-27(22)17-11-4-3-5-12-17)23(28)26(21)20-14-8-10-16-9-6-7-13-18(16)20/h3-15H,2H2,1H3
InChIKeyHPJUPNZKCPPXIY-UHFFFAOYSA-N
XLogP4.29
TPSA52.71 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.42
LogP ≤ 54.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

5-(2-chlorophenyl)-6-methyl-1-phenylpyrazolo[5,4-d]pyrimidin-4-one
CID 15207261
6-(2-methylanilino)-5-(2-methylphenyl)-1-phenylpyrazolo[5,4-d]pyrimidin-4-one
CID 10549386
5-(4-fluorophenyl)-6-methyl-1-phenylpyrazolo[5,4-d]pyrimidin-4-one
CID 122190733
5-(3-methylphenyl)-1,6-diphenylpyrazolo[5,4-d]pyrimidin-4-one
CID 1347889
5-(3-methylphenyl)-6-(4-methylphenyl)-1-phenylpyrazolo[5,4-d]pyrimidin-4-one
CID 4612081
2-ethyl-3-phenylquinazolin-4-one
CID 719985
5-(4-methoxyphenyl)-1,6-diphenylpyrazolo[5,4-d]pyrimidin-4-one
CID 67281727
6-(2,6-dimethylanilino)-5-(2,6-dimethylphenyl)-1-phenylpyrazolo[5,4-d]pyrimidin-4-one
CID 10574898
6-methyl-5-[(4-methylphenyl)methyl]-1-phenylpyrazolo[5,4-d]pyrimidin-4-one
CID 23905910
5-(4-methoxyphenyl)-6-(4-methylphenyl)-1-phenylpyrazolo[5,4-d]pyrimidin-4-one
CID 2275304
6-(2,4-dimethylanilino)-5-(2,4-dimethylphenyl)-1-phenylpyrazolo[5,4-d]pyrimidin-4-one
CID 10765336
6-(2-fluorophenyl)-5-(4-fluorophenyl)-1-phenylpyrazolo[5,4-d]pyrimidin-4-one
CID 1068283

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-5-naphthalen-1-yl-1-phenylpyrazolo[5,4-d]pyrimidin-4-one?
The IUPAC name of 6-ethyl-5-naphthalen-1-yl-1-phenylpyrazolo[5,4-d]pyrimidin-4-one (CID 1204122) is 6-ethyl-5-naphthalen-1-yl-1-phenylpyrazolo[5,4-d]pyrimidin-4-one.
What is the SMILES notation for 6-ethyl-5-naphthalen-1-yl-1-phenylpyrazolo[5,4-d]pyrimidin-4-one?
The canonical SMILES for 6-ethyl-5-naphthalen-1-yl-1-phenylpyrazolo[5,4-d]pyrimidin-4-one is CCc1nc2c(cnn2-c2ccccc2)c(=O)n1-c1cccc2ccccc12.
What is the InChIKey of 6-ethyl-5-naphthalen-1-yl-1-phenylpyrazolo[5,4-d]pyrimidin-4-one?
The InChIKey is HPJUPNZKCPPXIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18N4O/c1-2-21-25-22-19(15-24-27(22)17-11-4-3-5-12-17)23(28)26(21)20-14-8-10-16-9-6-7-13-18(16)20/h3-15H,2H2,1H3.
What are the key properties of 6-ethyl-5-naphthalen-1-yl-1-phenylpyrazolo[5,4-d]pyrimidin-4-one?
6-ethyl-5-naphthalen-1-yl-1-phenylpyrazolo[5,4-d]pyrimidin-4-one has a molecular weight of 366.42 g/mol, XLogP of 4.29, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-5-naphthalen-1-yl-1-phenylpyrazolo[5,4-d]pyrimidin-4-one is sourced from PubChem (CID 1204122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).