1,3-dimethyl-6-[3-(morpholine-4-carbonyl)piperidin-1-yl]pyrimidine-2,4-dione

C16H24N4O4 — CID 53010391

IUPAC1,3-dimethyl-6-[3-(morpholine-4-carbonyl)piperidin-1-yl]pyrimidine-2,4-dione
SMILESCn1c(N2CCCC(C(=O)N3CCOCC3)C2)cc(=O)n(C)c1=O
InChIInChI=1S/C16H24N4O4/c1-17-13(10-14(21)18(2)16(17)23)20-5-3-4-12(11-20)15(22)19-6-8-24-9-7-19/h10,12H,3-9,11H2,1-2H3
InChIKeyFMQSXBZSBPZMMY-UHFFFAOYSA-N
MW336.39 g/mol
LogP-0.84
Rot. Bonds2

About 1,3-dimethyl-6-[3-(morpholine-4-carbonyl)piperidin-1-yl]pyrimidine-2,4-dione

1,3-dimethyl-6-[3-(morpholine-4-carbonyl)piperidin-1-yl]pyrimidine-2,4-dione (PubChem CID 53010391) has the molecular formula C16H24N4O4 and a molecular weight of 336.39 g/mol. Its IUPAC name is 1,3-dimethyl-6-[3-(morpholine-4-carbonyl)piperidin-1-yl]pyrimidine-2,4-dione.

Molecular Properties

Compound Name1,3-dimethyl-6-[3-(morpholine-4-carbonyl)piperidin-1-yl]pyrimidine-2,4-dione
PubChem CID53010391
Molecular FormulaC16H24N4O4
Molecular Weight336.39 g/mol
Exact Mass336.18
IUPAC Name1,3-dimethyl-6-[3-(morpholine-4-carbonyl)piperidin-1-yl]pyrimidine-2,4-dione
SMILESCn1c(N2CCCC(C(=O)N3CCOCC3)C2)cc(=O)n(C)c1=O
InChIInChI=1S/C16H24N4O4/c1-17-13(10-14(21)18(2)16(17)23)20-5-3-4-12(11-20)15(22)19-6-8-24-9-7-19/h10,12H,3-9,11H2,1-2H3
InChIKeyFMQSXBZSBPZMMY-UHFFFAOYSA-N
XLogP-0.84
TPSA76.78 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.39
LogP ≤ 5-0.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 1,3-dimethyl-6-[3-(morpholine-4-carbonyl)piperidin-1-yl]pyrimidine-2,4-dione with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1,3-dimethyl-6-[3-(morpholine-4-carbonyl)piperidin-1-yl]pyrimidine-2,4-dione?
The IUPAC name of 1,3-dimethyl-6-[3-(morpholine-4-carbonyl)piperidin-1-yl]pyrimidine-2,4-dione (CID 53010391) is 1,3-dimethyl-6-[3-(morpholine-4-carbonyl)piperidin-1-yl]pyrimidine-2,4-dione.
What is the SMILES notation for 1,3-dimethyl-6-[3-(morpholine-4-carbonyl)piperidin-1-yl]pyrimidine-2,4-dione?
The canonical SMILES for 1,3-dimethyl-6-[3-(morpholine-4-carbonyl)piperidin-1-yl]pyrimidine-2,4-dione is Cn1c(N2CCCC(C(=O)N3CCOCC3)C2)cc(=O)n(C)c1=O.
What is the InChIKey of 1,3-dimethyl-6-[3-(morpholine-4-carbonyl)piperidin-1-yl]pyrimidine-2,4-dione?
The InChIKey is FMQSXBZSBPZMMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4O4/c1-17-13(10-14(21)18(2)16(17)23)20-5-3-4-12(11-20)15(22)19-6-8-24-9-7-19/h10,12H,3-9,11H2,1-2H3.
What are the key properties of 1,3-dimethyl-6-[3-(morpholine-4-carbonyl)piperidin-1-yl]pyrimidine-2,4-dione?
1,3-dimethyl-6-[3-(morpholine-4-carbonyl)piperidin-1-yl]pyrimidine-2,4-dione has a molecular weight of 336.39 g/mol, XLogP of -0.84, 2 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dimethyl-6-[3-(morpholine-4-carbonyl)piperidin-1-yl]pyrimidine-2,4-dione is sourced from PubChem (CID 53010391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).