2-anilino-8-(2-naphthalen-2-ylethyl)pyrido[2,3-d]pyrimidin-7-one

C25H20N4O — CID 18375323

IUPAC2-anilino-8-(2-naphthalen-2-ylethyl)pyrido[2,3-d]pyrimidin-7-one
SMILESO=c1ccc2cnc(Nc3ccccc3)nc2n1CCc1ccc2ccccc2c1
InChIInChI=1S/C25H20N4O/c30-23-13-12-21-17-26-25(27-22-8-2-1-3-9-22)28-24(21)29(23)15-14-18-10-11-19-6-4-5-7-20(19)16-18/h1-13,16-17H,14-15H2,(H,26,27,28)
InChIKeySCDVNYWJURYFQA-UHFFFAOYSA-N
MW392.46 g/mol
LogP4.93
Rot. Bonds5

About 2-anilino-8-(2-naphthalen-2-ylethyl)pyrido[2,3-d]pyrimidin-7-one

2-anilino-8-(2-naphthalen-2-ylethyl)pyrido[2,3-d]pyrimidin-7-one (PubChem CID 18375323) has the molecular formula C25H20N4O and a molecular weight of 392.46 g/mol. Its IUPAC name is 2-anilino-8-(2-naphthalen-2-ylethyl)pyrido[2,3-d]pyrimidin-7-one.

Molecular Properties

Compound Name2-anilino-8-(2-naphthalen-2-ylethyl)pyrido[2,3-d]pyrimidin-7-one
PubChem CID18375323
Molecular FormulaC25H20N4O
Molecular Weight392.46 g/mol
Exact Mass392.16
IUPAC Name2-anilino-8-(2-naphthalen-2-ylethyl)pyrido[2,3-d]pyrimidin-7-one
SMILESO=c1ccc2cnc(Nc3ccccc3)nc2n1CCc1ccc2ccccc2c1
InChIInChI=1S/C25H20N4O/c30-23-13-12-21-17-26-25(27-22-8-2-1-3-9-22)28-24(21)29(23)15-14-18-10-11-19-6-4-5-7-20(19)16-18/h1-13,16-17H,14-15H2,(H,26,27,28)
InChIKeySCDVNYWJURYFQA-UHFFFAOYSA-N
XLogP4.93
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.46
LogP ≤ 54.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-anilino-8-butylpyrido[2,3-d]pyrimidin-7-one
CID 5330228
2-anilino-8-[(3,5-dimethoxyphenyl)methyl]pyrido[2,3-d]pyrimidin-7-one
CID 18374812
2-anilino-8-[[2-(2-phenylethyl)phenyl]methyl]pyrido[2,3-d]pyrimidin-7-one
CID 18374839
2-anilino-8-[(3-methylphenyl)methyl]pyrido[2,3-d]pyrimidin-7-one
CID 18374901
2-(3-iodoanilino)-8-propylpyrido[2,3-d]pyrimidin-7-one
CID 10294727
2-(3-hydroxyanilino)-8-pentylpyrido[2,3-d]pyrimidin-7-one
CID 70112446
8-ethyl-2-(4-pyrrol-1-ylanilino)pyrido[2,3-d]pyrimidin-7-one
CID 5330218
8-[(3-phenoxyphenyl)methyl]-2-(4-pyrazol-1-ylanilino)pyrido[2,3-d]pyrimidin-7-one
CID 18375307
2-anilino-8-benzhydrylpyrido[2,3-d]pyrimidin-7-one
CID 18374988
8-ethyl-2-(4-fluoroanilino)pyrido[2,3-d]pyrimidin-7-one
CID 5330206
benzene;8-ethyl-2-[4-(4-methylpiperazin-1-yl)anilino]pyrido[2,3-d]pyrimidin-7-one
CID 159793843
2-[4-(4-methylpiperazin-1-yl)anilino]-8-[[2-(2-phenylethyl)phenyl]methyl]pyrido[2,3-d]pyrimidin-7-one
CID 18375026

Frequently Asked Questions

What is the IUPAC name of 2-anilino-8-(2-naphthalen-2-ylethyl)pyrido[2,3-d]pyrimidin-7-one?
The IUPAC name of 2-anilino-8-(2-naphthalen-2-ylethyl)pyrido[2,3-d]pyrimidin-7-one (CID 18375323) is 2-anilino-8-(2-naphthalen-2-ylethyl)pyrido[2,3-d]pyrimidin-7-one.
What is the SMILES notation for 2-anilino-8-(2-naphthalen-2-ylethyl)pyrido[2,3-d]pyrimidin-7-one?
The canonical SMILES for 2-anilino-8-(2-naphthalen-2-ylethyl)pyrido[2,3-d]pyrimidin-7-one is O=c1ccc2cnc(Nc3ccccc3)nc2n1CCc1ccc2ccccc2c1.
What is the InChIKey of 2-anilino-8-(2-naphthalen-2-ylethyl)pyrido[2,3-d]pyrimidin-7-one?
The InChIKey is SCDVNYWJURYFQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H20N4O/c30-23-13-12-21-17-26-25(27-22-8-2-1-3-9-22)28-24(21)29(23)15-14-18-10-11-19-6-4-5-7-20(19)16-18/h1-13,16-17H,14-15H2,(H,26,27,28).
What are the key properties of 2-anilino-8-(2-naphthalen-2-ylethyl)pyrido[2,3-d]pyrimidin-7-one?
2-anilino-8-(2-naphthalen-2-ylethyl)pyrido[2,3-d]pyrimidin-7-one has a molecular weight of 392.46 g/mol, XLogP of 4.93, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-anilino-8-(2-naphthalen-2-ylethyl)pyrido[2,3-d]pyrimidin-7-one is sourced from PubChem (CID 18375323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).