2-(2,4-dioxopyrimidin-1-yl)-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]acetamide

C16H19N5O4 — CID 37489706

IUPAC2-(2,4-dioxopyrimidin-1-yl)-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]acetamide
SMILESO=C(Cn1ccc(=O)[nH]c1=O)NCc1cccnc1N1CCOCC1
InChIInChI=1S/C16H19N5O4/c22-13-3-5-21(16(24)19-13)11-14(23)18-10-12-2-1-4-17-15(12)20-6-8-25-9-7-20/h1-5H,6-11H2,(H,18,23)(H,19,22,24)
InChIKeyQNUICMITNLQJAB-UHFFFAOYSA-N
MW345.36 g/mol
LogP-0.92
Rot. Bonds5

About 2-(2,4-dioxopyrimidin-1-yl)-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]acetamide

2-(2,4-dioxopyrimidin-1-yl)-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]acetamide (PubChem CID 37489706) has the molecular formula C16H19N5O4 and a molecular weight of 345.36 g/mol. Its IUPAC name is 2-(2,4-dioxopyrimidin-1-yl)-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]acetamide.

Molecular Properties

Compound Name2-(2,4-dioxopyrimidin-1-yl)-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]acetamide
PubChem CID37489706
Molecular FormulaC16H19N5O4
Molecular Weight345.36 g/mol
Exact Mass345.14
IUPAC Name2-(2,4-dioxopyrimidin-1-yl)-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]acetamide
SMILESO=C(Cn1ccc(=O)[nH]c1=O)NCc1cccnc1N1CCOCC1
InChIInChI=1S/C16H19N5O4/c22-13-3-5-21(16(24)19-13)11-14(23)18-10-12-2-1-4-17-15(12)20-6-8-25-9-7-20/h1-5H,6-11H2,(H,18,23)(H,19,22,24)
InChIKeyQNUICMITNLQJAB-UHFFFAOYSA-N
XLogP-0.92
TPSA109.32 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.36
LogP ≤ 5-0.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dioxopyrimidin-1-yl)-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]acetamide?
The IUPAC name of 2-(2,4-dioxopyrimidin-1-yl)-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]acetamide (CID 37489706) is 2-(2,4-dioxopyrimidin-1-yl)-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]acetamide.
What is the SMILES notation for 2-(2,4-dioxopyrimidin-1-yl)-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]acetamide?
The canonical SMILES for 2-(2,4-dioxopyrimidin-1-yl)-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]acetamide is O=C(Cn1ccc(=O)[nH]c1=O)NCc1cccnc1N1CCOCC1.
What is the InChIKey of 2-(2,4-dioxopyrimidin-1-yl)-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]acetamide?
The InChIKey is QNUICMITNLQJAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N5O4/c22-13-3-5-21(16(24)19-13)11-14(23)18-10-12-2-1-4-17-15(12)20-6-8-25-9-7-20/h1-5H,6-11H2,(H,18,23)(H,19,22,24).
What are the key properties of 2-(2,4-dioxopyrimidin-1-yl)-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]acetamide?
2-(2,4-dioxopyrimidin-1-yl)-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]acetamide has a molecular weight of 345.36 g/mol, XLogP of -0.92, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dioxopyrimidin-1-yl)-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]acetamide is sourced from PubChem (CID 37489706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).