2-[2-methoxyethyl-(4-methylpyrimidin-2-yl)amino]-N,N-dimethylacetamide

C12H20N4O2 — CID 71925055

IUPAC2-[2-methoxyethyl-(4-methylpyrimidin-2-yl)amino]-N,N-dimethylacetamide
SMILESCOCCN(CC(=O)N(C)C)c1nccc(C)n1
InChIInChI=1S/C12H20N4O2/c1-10-5-6-13-12(14-10)16(7-8-18-4)9-11(17)15(2)3/h5-6H,7-9H2,1-4H3
InChIKeySOXOIAUQSZQHMH-UHFFFAOYSA-N
MW252.32 g/mol
LogP0.33
Rot. Bonds6

About 2-[2-methoxyethyl-(4-methylpyrimidin-2-yl)amino]-N,N-dimethylacetamide

2-[2-methoxyethyl-(4-methylpyrimidin-2-yl)amino]-N,N-dimethylacetamide (PubChem CID 71925055) has the molecular formula C12H20N4O2 and a molecular weight of 252.32 g/mol. Its IUPAC name is 2-[2-methoxyethyl-(4-methylpyrimidin-2-yl)amino]-N,N-dimethylacetamide.

Molecular Properties

Compound Name2-[2-methoxyethyl-(4-methylpyrimidin-2-yl)amino]-N,N-dimethylacetamide
PubChem CID71925055
Molecular FormulaC12H20N4O2
Molecular Weight252.32 g/mol
Exact Mass252.16
IUPAC Name2-[2-methoxyethyl-(4-methylpyrimidin-2-yl)amino]-N,N-dimethylacetamide
SMILESCOCCN(CC(=O)N(C)C)c1nccc(C)n1
InChIInChI=1S/C12H20N4O2/c1-10-5-6-13-12(14-10)16(7-8-18-4)9-11(17)15(2)3/h5-6H,7-9H2,1-4H3
InChIKeySOXOIAUQSZQHMH-UHFFFAOYSA-N
XLogP0.33
TPSA58.56 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 50.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[2-methoxyethyl-(4-methylpyrimidin-2-yl)amino]-N,N-dimethylacetamide?
The IUPAC name of 2-[2-methoxyethyl-(4-methylpyrimidin-2-yl)amino]-N,N-dimethylacetamide (CID 71925055) is 2-[2-methoxyethyl-(4-methylpyrimidin-2-yl)amino]-N,N-dimethylacetamide.
What is the SMILES notation for 2-[2-methoxyethyl-(4-methylpyrimidin-2-yl)amino]-N,N-dimethylacetamide?
The canonical SMILES for 2-[2-methoxyethyl-(4-methylpyrimidin-2-yl)amino]-N,N-dimethylacetamide is COCCN(CC(=O)N(C)C)c1nccc(C)n1.
What is the InChIKey of 2-[2-methoxyethyl-(4-methylpyrimidin-2-yl)amino]-N,N-dimethylacetamide?
The InChIKey is SOXOIAUQSZQHMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O2/c1-10-5-6-13-12(14-10)16(7-8-18-4)9-11(17)15(2)3/h5-6H,7-9H2,1-4H3.
What are the key properties of 2-[2-methoxyethyl-(4-methylpyrimidin-2-yl)amino]-N,N-dimethylacetamide?
2-[2-methoxyethyl-(4-methylpyrimidin-2-yl)amino]-N,N-dimethylacetamide has a molecular weight of 252.32 g/mol, XLogP of 0.33, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-methoxyethyl-(4-methylpyrimidin-2-yl)amino]-N,N-dimethylacetamide is sourced from PubChem (CID 71925055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).