N-(4,6-dimethylpyrimidin-2-yl)-2-morpholin-2-ylacetamide

C12H18N4O2 — CID 66433769

IUPACN-(4,6-dimethylpyrimidin-2-yl)-2-morpholin-2-ylacetamide
SMILESCc1cc(C)nc(NC(=O)CC2CNCCO2)n1
InChIInChI=1S/C12H18N4O2/c1-8-5-9(2)15-12(14-8)16-11(17)6-10-7-13-3-4-18-10/h5,10,13H,3-4,6-7H2,1-2H3,(H,14,15,16,17)
InChIKeyLCAHEVXXAMYEDL-UHFFFAOYSA-N
MW250.30 g/mol
LogP0.41
Rot. Bonds3

About N-(4,6-dimethylpyrimidin-2-yl)-2-morpholin-2-ylacetamide

N-(4,6-dimethylpyrimidin-2-yl)-2-morpholin-2-ylacetamide (PubChem CID 66433769) has the molecular formula C12H18N4O2 and a molecular weight of 250.30 g/mol. Its IUPAC name is N-(4,6-dimethylpyrimidin-2-yl)-2-morpholin-2-ylacetamide.

Molecular Properties

Compound NameN-(4,6-dimethylpyrimidin-2-yl)-2-morpholin-2-ylacetamide
PubChem CID66433769
Molecular FormulaC12H18N4O2
Molecular Weight250.30 g/mol
Exact Mass250.14
IUPAC NameN-(4,6-dimethylpyrimidin-2-yl)-2-morpholin-2-ylacetamide
SMILESCc1cc(C)nc(NC(=O)CC2CNCCO2)n1
InChIInChI=1S/C12H18N4O2/c1-8-5-9(2)15-12(14-8)16-11(17)6-10-7-13-3-4-18-10/h5,10,13H,3-4,6-7H2,1-2H3,(H,14,15,16,17)
InChIKeyLCAHEVXXAMYEDL-UHFFFAOYSA-N
XLogP0.41
TPSA76.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 50.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(4,6-dimethylpyrimidin-2-yl)-2-morpholin-2-ylacetamide?
The IUPAC name of N-(4,6-dimethylpyrimidin-2-yl)-2-morpholin-2-ylacetamide (CID 66433769) is N-(4,6-dimethylpyrimidin-2-yl)-2-morpholin-2-ylacetamide.
What is the SMILES notation for N-(4,6-dimethylpyrimidin-2-yl)-2-morpholin-2-ylacetamide?
The canonical SMILES for N-(4,6-dimethylpyrimidin-2-yl)-2-morpholin-2-ylacetamide is Cc1cc(C)nc(NC(=O)CC2CNCCO2)n1.
What is the InChIKey of N-(4,6-dimethylpyrimidin-2-yl)-2-morpholin-2-ylacetamide?
The InChIKey is LCAHEVXXAMYEDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O2/c1-8-5-9(2)15-12(14-8)16-11(17)6-10-7-13-3-4-18-10/h5,10,13H,3-4,6-7H2,1-2H3,(H,14,15,16,17).
What are the key properties of N-(4,6-dimethylpyrimidin-2-yl)-2-morpholin-2-ylacetamide?
N-(4,6-dimethylpyrimidin-2-yl)-2-morpholin-2-ylacetamide has a molecular weight of 250.30 g/mol, XLogP of 0.41, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,6-dimethylpyrimidin-2-yl)-2-morpholin-2-ylacetamide is sourced from PubChem (CID 66433769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).