1,3-dimethyl-7-morpholin-4-yl-8H-pyrido[2,3-d]pyrimidine-2,4,5-trione

C13H16N4O4 — CID 164519538

IUPAC1,3-dimethyl-7-morpholin-4-yl-8H-pyrido[2,3-d]pyrimidine-2,4,5-trione
SMILESCn1c(=O)c2c(=O)cc(N3CCOCC3)[nH]c2n(C)c1=O
InChIInChI=1S/C13H16N4O4/c1-15-11-10(12(19)16(2)13(15)20)8(18)7-9(14-11)17-3-5-21-6-4-17/h7H,3-6H2,1-2H3,(H,14,18)
InChIKeyBCQBFZJHYJYBSC-UHFFFAOYSA-N
MW292.30 g/mol
LogP-1.24
Rot. Bonds1

About 1,3-dimethyl-7-morpholin-4-yl-8H-pyrido[2,3-d]pyrimidine-2,4,5-trione

1,3-dimethyl-7-morpholin-4-yl-8H-pyrido[2,3-d]pyrimidine-2,4,5-trione (PubChem CID 164519538) has the molecular formula C13H16N4O4 and a molecular weight of 292.30 g/mol. Its IUPAC name is 1,3-dimethyl-7-morpholin-4-yl-8H-pyrido[2,3-d]pyrimidine-2,4,5-trione.

Molecular Properties

Compound Name1,3-dimethyl-7-morpholin-4-yl-8H-pyrido[2,3-d]pyrimidine-2,4,5-trione
PubChem CID164519538
Molecular FormulaC13H16N4O4
Molecular Weight292.30 g/mol
Exact Mass292.12
IUPAC Name1,3-dimethyl-7-morpholin-4-yl-8H-pyrido[2,3-d]pyrimidine-2,4,5-trione
SMILESCn1c(=O)c2c(=O)cc(N3CCOCC3)[nH]c2n(C)c1=O
InChIInChI=1S/C13H16N4O4/c1-15-11-10(12(19)16(2)13(15)20)8(18)7-9(14-11)17-3-5-21-6-4-17/h7H,3-6H2,1-2H3,(H,14,18)
InChIKeyBCQBFZJHYJYBSC-UHFFFAOYSA-N
XLogP-1.24
TPSA89.33 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.30
LogP ≤ 5-1.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 1,3-dimethyl-7-morpholin-4-yl-8H-pyrido[2,3-d]pyrimidine-2,4,5-trione with MolForge

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Related Compounds

6-Amino-5-[2-(2,6-dimethylmorpholin-4-yl)acetyl]-1-(2-methoxyethyl)pyrimidine-2,4-dione
CID 42927005
Pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione, 5-hydroxy-1,3-dimethyl-7-(4-methylpiperazin-1-yl)-
CID 616532
6-Amino-5-[2-(morpholin-4-yl)-2-oxoacetyl]-1,2,3,4-tetrahydropyrimidine-2,4-dione
CID 129753535
6-Amino-1,3-dimethyl-5-[(2-morpholin-4-yl)-2-oxoacetyl]-1,2,3,4-tetrahydropyrimidine-2,4-dione
CID 129753675
6-Amino-1,3-dimethyl-5-(2-morpholin-4-ylacetyl)pyrimidine-2,4-dione
CID 4360558
6-Amino-5-[2-(2,6-dimethylmorpholin-4-yl)acetyl]-1-propylpyrimidine-2,4-dione
CID 4849753
6-Amino-5-(2-morpholin-4-ylacetyl)-1-propylpyrimidine-2,4-dione
CID 4851826
6-Amino-5-[2-(2,6-dimethylmorpholin-4-yl)acetyl]-3-methyl-1-propylpyrimidine-2,4-dione
CID 16554569
6-amino-5-[2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]acetyl]-3-methyl-1-propylpyrimidine-2,4-dione
CID 2681682
6-amino-5-[2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]acetyl]-3-methyl-1-propylpyrimidine-2,4-dione
CID 2681685
6-amino-5-[2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]acetyl]-3-methyl-1-propylpyrimidine-2,4-dione
CID 2681688
6-Amino-3-methyl-5-(2-morpholin-4-ium-4-ylacetyl)-1-propylpyrimidine-2,4-dione
CID 2682261

Frequently Asked Questions

What is the IUPAC name of 1,3-dimethyl-7-morpholin-4-yl-8H-pyrido[2,3-d]pyrimidine-2,4,5-trione?
The IUPAC name of 1,3-dimethyl-7-morpholin-4-yl-8H-pyrido[2,3-d]pyrimidine-2,4,5-trione (CID 164519538) is 1,3-dimethyl-7-morpholin-4-yl-8H-pyrido[2,3-d]pyrimidine-2,4,5-trione.
What is the SMILES notation for 1,3-dimethyl-7-morpholin-4-yl-8H-pyrido[2,3-d]pyrimidine-2,4,5-trione?
The canonical SMILES for 1,3-dimethyl-7-morpholin-4-yl-8H-pyrido[2,3-d]pyrimidine-2,4,5-trione is Cn1c(=O)c2c(=O)cc(N3CCOCC3)[nH]c2n(C)c1=O.
What is the InChIKey of 1,3-dimethyl-7-morpholin-4-yl-8H-pyrido[2,3-d]pyrimidine-2,4,5-trione?
The InChIKey is BCQBFZJHYJYBSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4O4/c1-15-11-10(12(19)16(2)13(15)20)8(18)7-9(14-11)17-3-5-21-6-4-17/h7H,3-6H2,1-2H3,(H,14,18).
What are the key properties of 1,3-dimethyl-7-morpholin-4-yl-8H-pyrido[2,3-d]pyrimidine-2,4,5-trione?
1,3-dimethyl-7-morpholin-4-yl-8H-pyrido[2,3-d]pyrimidine-2,4,5-trione has a molecular weight of 292.30 g/mol, XLogP of -1.24, 1 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dimethyl-7-morpholin-4-yl-8H-pyrido[2,3-d]pyrimidine-2,4,5-trione is sourced from PubChem (CID 164519538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).