1-methyl-7-[(3R)-3-methylmorpholine-4-carbonyl]pyrido[2,3-d]pyrimidine-2,4-dione

C14H16N4O4 — CID 37192691

IUPAC1-methyl-7-[(3R)-3-methylmorpholine-4-carbonyl]pyrido[2,3-d]pyrimidine-2,4-dione
SMILESC[C@@H]1COCCN1C(=O)c1ccc2c(=O)[nH]c(=O)n(C)c2n1
InChIInChI=1S/C14H16N4O4/c1-8-7-22-6-5-18(8)13(20)10-4-3-9-11(15-10)17(2)14(21)16-12(9)19/h3-4,8H,5-7H2,1-2H3,(H,16,19,21)/t8-/m1/s1
InChIKeyQREYCUFZNVEVHJ-MRVPVSSYSA-N
MW304.31 g/mol
LogP-0.52
Rot. Bonds1

About 1-methyl-7-[(3R)-3-methylmorpholine-4-carbonyl]pyrido[2,3-d]pyrimidine-2,4-dione

1-methyl-7-[(3R)-3-methylmorpholine-4-carbonyl]pyrido[2,3-d]pyrimidine-2,4-dione (PubChem CID 37192691) has the molecular formula C14H16N4O4 and a molecular weight of 304.31 g/mol. Its IUPAC name is 1-methyl-7-[(3R)-3-methylmorpholine-4-carbonyl]pyrido[2,3-d]pyrimidine-2,4-dione.

Molecular Properties

Compound Name1-methyl-7-[(3R)-3-methylmorpholine-4-carbonyl]pyrido[2,3-d]pyrimidine-2,4-dione
PubChem CID37192691
Molecular FormulaC14H16N4O4
Molecular Weight304.31 g/mol
Exact Mass304.12
IUPAC Name1-methyl-7-[(3R)-3-methylmorpholine-4-carbonyl]pyrido[2,3-d]pyrimidine-2,4-dione
SMILESC[C@@H]1COCCN1C(=O)c1ccc2c(=O)[nH]c(=O)n(C)c2n1
InChIInChI=1S/C14H16N4O4/c1-8-7-22-6-5-18(8)13(20)10-4-3-9-11(15-10)17(2)14(21)16-12(9)19/h3-4,8H,5-7H2,1-2H3,(H,16,19,21)/t8-/m1/s1
InChIKeyQREYCUFZNVEVHJ-MRVPVSSYSA-N
XLogP-0.52
TPSA97.29 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.31
LogP ≤ 5-0.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-7-[(3R)-3-methylmorpholine-4-carbonyl]pyrido[2,3-d]pyrimidine-2,4-dione?
The IUPAC name of 1-methyl-7-[(3R)-3-methylmorpholine-4-carbonyl]pyrido[2,3-d]pyrimidine-2,4-dione (CID 37192691) is 1-methyl-7-[(3R)-3-methylmorpholine-4-carbonyl]pyrido[2,3-d]pyrimidine-2,4-dione.
What is the SMILES notation for 1-methyl-7-[(3R)-3-methylmorpholine-4-carbonyl]pyrido[2,3-d]pyrimidine-2,4-dione?
The canonical SMILES for 1-methyl-7-[(3R)-3-methylmorpholine-4-carbonyl]pyrido[2,3-d]pyrimidine-2,4-dione is C[C@@H]1COCCN1C(=O)c1ccc2c(=O)[nH]c(=O)n(C)c2n1.
What is the InChIKey of 1-methyl-7-[(3R)-3-methylmorpholine-4-carbonyl]pyrido[2,3-d]pyrimidine-2,4-dione?
The InChIKey is QREYCUFZNVEVHJ-MRVPVSSYSA-N. The full InChI is InChI=1S/C14H16N4O4/c1-8-7-22-6-5-18(8)13(20)10-4-3-9-11(15-10)17(2)14(21)16-12(9)19/h3-4,8H,5-7H2,1-2H3,(H,16,19,21)/t8-/m1/s1.
What are the key properties of 1-methyl-7-[(3R)-3-methylmorpholine-4-carbonyl]pyrido[2,3-d]pyrimidine-2,4-dione?
1-methyl-7-[(3R)-3-methylmorpholine-4-carbonyl]pyrido[2,3-d]pyrimidine-2,4-dione has a molecular weight of 304.31 g/mol, XLogP of -0.52, 1 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-7-[(3R)-3-methylmorpholine-4-carbonyl]pyrido[2,3-d]pyrimidine-2,4-dione is sourced from PubChem (CID 37192691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).