2-(4,5-dimethyl-6-oxopyrimidin-1-yl)-N-(6-morpholin-4-ylpyrimidin-4-yl)acetamide

C16H20N6O3 — CID 90544343

IUPAC2-(4,5-dimethyl-6-oxopyrimidin-1-yl)-N-(6-morpholin-4-ylpyrimidin-4-yl)acetamide
SMILESCc1ncn(CC(=O)Nc2cc(N3CCOCC3)ncn2)c(=O)c1C
InChIInChI=1S/C16H20N6O3/c1-11-12(2)19-10-22(16(11)24)8-15(23)20-13-7-14(18-9-17-13)21-3-5-25-6-4-21/h7,9-10H,3-6,8H2,1-2H3,(H,17,18,20,23)
InChIKeyGCYIDIFMNUAUCC-UHFFFAOYSA-N
MW344.38 g/mol
LogP0.13
Rot. Bonds4

About 2-(4,5-dimethyl-6-oxopyrimidin-1-yl)-N-(6-morpholin-4-ylpyrimidin-4-yl)acetamide

2-(4,5-dimethyl-6-oxopyrimidin-1-yl)-N-(6-morpholin-4-ylpyrimidin-4-yl)acetamide (PubChem CID 90544343) has the molecular formula C16H20N6O3 and a molecular weight of 344.38 g/mol. Its IUPAC name is 2-(4,5-dimethyl-6-oxopyrimidin-1-yl)-N-(6-morpholin-4-ylpyrimidin-4-yl)acetamide.

Molecular Properties

Compound Name2-(4,5-dimethyl-6-oxopyrimidin-1-yl)-N-(6-morpholin-4-ylpyrimidin-4-yl)acetamide
PubChem CID90544343
Molecular FormulaC16H20N6O3
Molecular Weight344.38 g/mol
Exact Mass344.16
IUPAC Name2-(4,5-dimethyl-6-oxopyrimidin-1-yl)-N-(6-morpholin-4-ylpyrimidin-4-yl)acetamide
SMILESCc1ncn(CC(=O)Nc2cc(N3CCOCC3)ncn2)c(=O)c1C
InChIInChI=1S/C16H20N6O3/c1-11-12(2)19-10-22(16(11)24)8-15(23)20-13-7-14(18-9-17-13)21-3-5-25-6-4-21/h7,9-10H,3-6,8H2,1-2H3,(H,17,18,20,23)
InChIKeyGCYIDIFMNUAUCC-UHFFFAOYSA-N
XLogP0.13
TPSA102.24 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.38
LogP ≤ 50.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Related Compounds

2-(4,5-dimethyl-6-oxopyrimidin-1-yl)-N-[6-(4-methylpiperidin-1-yl)pyrimidin-4-yl]acetamide
CID 90546186
2-(4-methyl-6-oxopyrimidin-1-yl)-N-(6-morpholin-4-ylpyrimidin-4-yl)acetamide
CID 90544256
N-(6-morpholin-4-ylpyrimidin-4-yl)-2-(4-oxoquinazolin-3-yl)acetamide
CID 71794855
N-(6-morpholin-4-ylpyrimidin-4-yl)-2-pyrrol-1-ylacetamide
CID 71794861
2-(4,5-dimethyl-6-oxopyrimidin-1-yl)-N-(2,4,6-trimethylphenyl)acetamide
CID 53014407
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(6-morpholin-4-ylpyrimidin-4-yl)acetamide
CID 90544318
2-(3-methylphenyl)-N-(6-morpholin-4-ylpyrimidin-4-yl)acetamide
CID 90544157
5,6-dimethyl-3-[2-oxo-2-[4-(6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]ethyl]pyrimidin-4-one
CID 122343093
2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-(6-piperidin-1-ylpyrimidin-4-yl)acetamide
CID 90544640
2-(4-methoxyphenyl)-N-(6-morpholin-4-ylpyrimidin-4-yl)acetamide
CID 90544086
2-(4,5-dimethyl-6-oxopyrimidin-1-yl)-N-[(2-morpholin-4-ylpyrimidin-4-yl)methyl]acetamide
CID 122353478
2-(3-methylphenoxy)-N-(6-morpholin-4-ylpyrimidin-4-yl)acetamide
CID 90544202

Frequently Asked Questions

What is the IUPAC name of 2-(4,5-dimethyl-6-oxopyrimidin-1-yl)-N-(6-morpholin-4-ylpyrimidin-4-yl)acetamide?
The IUPAC name of 2-(4,5-dimethyl-6-oxopyrimidin-1-yl)-N-(6-morpholin-4-ylpyrimidin-4-yl)acetamide (CID 90544343) is 2-(4,5-dimethyl-6-oxopyrimidin-1-yl)-N-(6-morpholin-4-ylpyrimidin-4-yl)acetamide.
What is the SMILES notation for 2-(4,5-dimethyl-6-oxopyrimidin-1-yl)-N-(6-morpholin-4-ylpyrimidin-4-yl)acetamide?
The canonical SMILES for 2-(4,5-dimethyl-6-oxopyrimidin-1-yl)-N-(6-morpholin-4-ylpyrimidin-4-yl)acetamide is Cc1ncn(CC(=O)Nc2cc(N3CCOCC3)ncn2)c(=O)c1C.
What is the InChIKey of 2-(4,5-dimethyl-6-oxopyrimidin-1-yl)-N-(6-morpholin-4-ylpyrimidin-4-yl)acetamide?
The InChIKey is GCYIDIFMNUAUCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N6O3/c1-11-12(2)19-10-22(16(11)24)8-15(23)20-13-7-14(18-9-17-13)21-3-5-25-6-4-21/h7,9-10H,3-6,8H2,1-2H3,(H,17,18,20,23).
What are the key properties of 2-(4,5-dimethyl-6-oxopyrimidin-1-yl)-N-(6-morpholin-4-ylpyrimidin-4-yl)acetamide?
2-(4,5-dimethyl-6-oxopyrimidin-1-yl)-N-(6-morpholin-4-ylpyrimidin-4-yl)acetamide has a molecular weight of 344.38 g/mol, XLogP of 0.13, 4 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,5-dimethyl-6-oxopyrimidin-1-yl)-N-(6-morpholin-4-ylpyrimidin-4-yl)acetamide is sourced from PubChem (CID 90544343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).