6-(morpholine-4-carbonyl)-1-propylpyrido[2,3-d]pyrimidine-2,4-dione

C15H18N4O4 — CID 36708442

IUPAC6-(morpholine-4-carbonyl)-1-propylpyrido[2,3-d]pyrimidine-2,4-dione
SMILESCCCn1c(=O)[nH]c(=O)c2cc(C(=O)N3CCOCC3)cnc21
InChIInChI=1S/C15H18N4O4/c1-2-3-19-12-11(13(20)17-15(19)22)8-10(9-16-12)14(21)18-4-6-23-7-5-18/h8-9H,2-7H2,1H3,(H,17,20,22)
InChIKeyWBEVNYFTULJOSQ-UHFFFAOYSA-N
MW318.33 g/mol
LogP-0.03
Rot. Bonds3

About 6-(morpholine-4-carbonyl)-1-propylpyrido[2,3-d]pyrimidine-2,4-dione

6-(morpholine-4-carbonyl)-1-propylpyrido[2,3-d]pyrimidine-2,4-dione (PubChem CID 36708442) has the molecular formula C15H18N4O4 and a molecular weight of 318.33 g/mol. Its IUPAC name is 6-(morpholine-4-carbonyl)-1-propylpyrido[2,3-d]pyrimidine-2,4-dione.

Molecular Properties

Compound Name6-(morpholine-4-carbonyl)-1-propylpyrido[2,3-d]pyrimidine-2,4-dione
PubChem CID36708442
Molecular FormulaC15H18N4O4
Molecular Weight318.33 g/mol
Exact Mass318.13
IUPAC Name6-(morpholine-4-carbonyl)-1-propylpyrido[2,3-d]pyrimidine-2,4-dione
SMILESCCCn1c(=O)[nH]c(=O)c2cc(C(=O)N3CCOCC3)cnc21
InChIInChI=1S/C15H18N4O4/c1-2-3-19-12-11(13(20)17-15(19)22)8-10(9-16-12)14(21)18-4-6-23-7-5-18/h8-9H,2-7H2,1H3,(H,17,20,22)
InChIKeyWBEVNYFTULJOSQ-UHFFFAOYSA-N
XLogP-0.03
TPSA97.29 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.33
LogP ≤ 5-0.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-(morpholine-4-carbonyl)-1-propylpyrido[2,3-d]pyrimidine-2,4-dione?
The IUPAC name of 6-(morpholine-4-carbonyl)-1-propylpyrido[2,3-d]pyrimidine-2,4-dione (CID 36708442) is 6-(morpholine-4-carbonyl)-1-propylpyrido[2,3-d]pyrimidine-2,4-dione.
What is the SMILES notation for 6-(morpholine-4-carbonyl)-1-propylpyrido[2,3-d]pyrimidine-2,4-dione?
The canonical SMILES for 6-(morpholine-4-carbonyl)-1-propylpyrido[2,3-d]pyrimidine-2,4-dione is CCCn1c(=O)[nH]c(=O)c2cc(C(=O)N3CCOCC3)cnc21.
What is the InChIKey of 6-(morpholine-4-carbonyl)-1-propylpyrido[2,3-d]pyrimidine-2,4-dione?
The InChIKey is WBEVNYFTULJOSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O4/c1-2-3-19-12-11(13(20)17-15(19)22)8-10(9-16-12)14(21)18-4-6-23-7-5-18/h8-9H,2-7H2,1H3,(H,17,20,22).
What are the key properties of 6-(morpholine-4-carbonyl)-1-propylpyrido[2,3-d]pyrimidine-2,4-dione?
6-(morpholine-4-carbonyl)-1-propylpyrido[2,3-d]pyrimidine-2,4-dione has a molecular weight of 318.33 g/mol, XLogP of -0.03, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(morpholine-4-carbonyl)-1-propylpyrido[2,3-d]pyrimidine-2,4-dione is sourced from PubChem (CID 36708442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).