6-hydroxy-2,4-dioxo-N-phenyl-1-(2,4,6-trimethylphenyl)pyrimidine-5-carboxamide

C20H19N3O4 — CID 66522790

IUPAC6-hydroxy-2,4-dioxo-N-phenyl-1-(2,4,6-trimethylphenyl)pyrimidine-5-carboxamide
SMILESCc1cc(C)c(-n2c(O)c(C(=O)Nc3ccccc3)c(=O)[nH]c2=O)c(C)c1
InChIInChI=1S/C20H19N3O4/c1-11-9-12(2)16(13(3)10-11)23-19(26)15(18(25)22-20(23)27)17(24)21-14-7-5-4-6-8-14/h4-10,26H,1-3H3,(H,21,24)(H,22,25,27)
InChIKeyPENWUVNKIXKCLH-UHFFFAOYSA-N
MW365.39 g/mol
LogP2.41
Rot. Bonds3

About 6-hydroxy-2,4-dioxo-N-phenyl-1-(2,4,6-trimethylphenyl)pyrimidine-5-carboxamide

6-hydroxy-2,4-dioxo-N-phenyl-1-(2,4,6-trimethylphenyl)pyrimidine-5-carboxamide (PubChem CID 66522790) has the molecular formula C20H19N3O4 and a molecular weight of 365.39 g/mol. Its IUPAC name is 6-hydroxy-2,4-dioxo-N-phenyl-1-(2,4,6-trimethylphenyl)pyrimidine-5-carboxamide.

Molecular Properties

Compound Name6-hydroxy-2,4-dioxo-N-phenyl-1-(2,4,6-trimethylphenyl)pyrimidine-5-carboxamide
PubChem CID66522790
Molecular FormulaC20H19N3O4
Molecular Weight365.39 g/mol
Exact Mass365.14
IUPAC Name6-hydroxy-2,4-dioxo-N-phenyl-1-(2,4,6-trimethylphenyl)pyrimidine-5-carboxamide
SMILESCc1cc(C)c(-n2c(O)c(C(=O)Nc3ccccc3)c(=O)[nH]c2=O)c(C)c1
InChIInChI=1S/C20H19N3O4/c1-11-9-12(2)16(13(3)10-11)23-19(26)15(18(25)22-20(23)27)17(24)21-14-7-5-4-6-8-14/h4-10,26H,1-3H3,(H,21,24)(H,22,25,27)
InChIKeyPENWUVNKIXKCLH-UHFFFAOYSA-N
XLogP2.41
TPSA104.19 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.39
LogP ≤ 52.41
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-hydroxy-2,4-dioxo-N-phenyl-1-(2,4,6-trimethylphenyl)pyrimidine-5-carboxamide?
The IUPAC name of 6-hydroxy-2,4-dioxo-N-phenyl-1-(2,4,6-trimethylphenyl)pyrimidine-5-carboxamide (CID 66522790) is 6-hydroxy-2,4-dioxo-N-phenyl-1-(2,4,6-trimethylphenyl)pyrimidine-5-carboxamide.
What is the SMILES notation for 6-hydroxy-2,4-dioxo-N-phenyl-1-(2,4,6-trimethylphenyl)pyrimidine-5-carboxamide?
The canonical SMILES for 6-hydroxy-2,4-dioxo-N-phenyl-1-(2,4,6-trimethylphenyl)pyrimidine-5-carboxamide is Cc1cc(C)c(-n2c(O)c(C(=O)Nc3ccccc3)c(=O)[nH]c2=O)c(C)c1.
What is the InChIKey of 6-hydroxy-2,4-dioxo-N-phenyl-1-(2,4,6-trimethylphenyl)pyrimidine-5-carboxamide?
The InChIKey is PENWUVNKIXKCLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O4/c1-11-9-12(2)16(13(3)10-11)23-19(26)15(18(25)22-20(23)27)17(24)21-14-7-5-4-6-8-14/h4-10,26H,1-3H3,(H,21,24)(H,22,25,27).
What are the key properties of 6-hydroxy-2,4-dioxo-N-phenyl-1-(2,4,6-trimethylphenyl)pyrimidine-5-carboxamide?
6-hydroxy-2,4-dioxo-N-phenyl-1-(2,4,6-trimethylphenyl)pyrimidine-5-carboxamide has a molecular weight of 365.39 g/mol, XLogP of 2.41, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydroxy-2,4-dioxo-N-phenyl-1-(2,4,6-trimethylphenyl)pyrimidine-5-carboxamide is sourced from PubChem (CID 66522790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).