5-(4-fluorophenyl)-7-phenyl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-2,4-dione

C19H14FN3O2 — CID 23790481

IUPAC5-(4-fluorophenyl)-7-phenyl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-2,4-dione
SMILESO=c1[nH]c2c(c(=O)[nH]1)C(c1ccc(F)cc1)C=C(c1ccccc1)N2
InChIInChI=1S/C19H14FN3O2/c20-13-8-6-11(7-9-13)14-10-15(12-4-2-1-3-5-12)21-17-16(14)18(24)23-19(25)22-17/h1-10,14H,(H3,21,22,23,24,25)
InChIKeyFRJAPZLEBMXGKK-UHFFFAOYSA-N
MW335.34 g/mol
LogP2.80
Rot. Bonds2

About 5-(4-fluorophenyl)-7-phenyl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-2,4-dione

5-(4-fluorophenyl)-7-phenyl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-2,4-dione (PubChem CID 23790481) has the molecular formula C19H14FN3O2 and a molecular weight of 335.34 g/mol. Its IUPAC name is 5-(4-fluorophenyl)-7-phenyl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-2,4-dione.

Molecular Properties

Compound Name5-(4-fluorophenyl)-7-phenyl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-2,4-dione
PubChem CID23790481
Molecular FormulaC19H14FN3O2
Molecular Weight335.34 g/mol
Exact Mass335.11
IUPAC Name5-(4-fluorophenyl)-7-phenyl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-2,4-dione
SMILESO=c1[nH]c2c(c(=O)[nH]1)C(c1ccc(F)cc1)C=C(c1ccccc1)N2
InChIInChI=1S/C19H14FN3O2/c20-13-8-6-11(7-9-13)14-10-15(12-4-2-1-3-5-12)21-17-16(14)18(24)23-19(25)22-17/h1-10,14H,(H3,21,22,23,24,25)
InChIKeyFRJAPZLEBMXGKK-UHFFFAOYSA-N
XLogP2.80
TPSA77.75 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.34
LogP ≤ 52.80
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(4-fluorophenyl)-7-phenyl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-2,4-dione?
The IUPAC name of 5-(4-fluorophenyl)-7-phenyl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-2,4-dione (CID 23790481) is 5-(4-fluorophenyl)-7-phenyl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-2,4-dione.
What is the SMILES notation for 5-(4-fluorophenyl)-7-phenyl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-2,4-dione?
The canonical SMILES for 5-(4-fluorophenyl)-7-phenyl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-2,4-dione is O=c1[nH]c2c(c(=O)[nH]1)C(c1ccc(F)cc1)C=C(c1ccccc1)N2.
What is the InChIKey of 5-(4-fluorophenyl)-7-phenyl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-2,4-dione?
The InChIKey is FRJAPZLEBMXGKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14FN3O2/c20-13-8-6-11(7-9-13)14-10-15(12-4-2-1-3-5-12)21-17-16(14)18(24)23-19(25)22-17/h1-10,14H,(H3,21,22,23,24,25).
What are the key properties of 5-(4-fluorophenyl)-7-phenyl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-2,4-dione?
5-(4-fluorophenyl)-7-phenyl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-2,4-dione has a molecular weight of 335.34 g/mol, XLogP of 2.80, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-fluorophenyl)-7-phenyl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-2,4-dione is sourced from PubChem (CID 23790481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).