2-[(4,6-dimethylpyrimidin-2-yl)amino]-N-ethylacetamide

C10H16N4O — CID 43420785

IUPAC2-[(4,6-dimethylpyrimidin-2-yl)amino]-N-ethylacetamide
SMILESCCNC(=O)CNc1nc(C)cc(C)n1
InChIInChI=1S/C10H16N4O/c1-4-11-9(15)6-12-10-13-7(2)5-8(3)14-10/h5H,4,6H2,1-3H3,(H,11,15)(H,12,13,14)
InChIKeyJMIUKPPUJOFKIH-UHFFFAOYSA-N
MW208.26 g/mol
LogP0.64
Rot. Bonds4

About 2-[(4,6-dimethylpyrimidin-2-yl)amino]-N-ethylacetamide

2-[(4,6-dimethylpyrimidin-2-yl)amino]-N-ethylacetamide (PubChem CID 43420785) has the molecular formula C10H16N4O and a molecular weight of 208.26 g/mol. Its IUPAC name is 2-[(4,6-dimethylpyrimidin-2-yl)amino]-N-ethylacetamide.

Molecular Properties

Compound Name2-[(4,6-dimethylpyrimidin-2-yl)amino]-N-ethylacetamide
PubChem CID43420785
Molecular FormulaC10H16N4O
Molecular Weight208.26 g/mol
Exact Mass208.13
IUPAC Name2-[(4,6-dimethylpyrimidin-2-yl)amino]-N-ethylacetamide
SMILESCCNC(=O)CNc1nc(C)cc(C)n1
InChIInChI=1S/C10H16N4O/c1-4-11-9(15)6-12-10-13-7(2)5-8(3)14-10/h5H,4,6H2,1-3H3,(H,11,15)(H,12,13,14)
InChIKeyJMIUKPPUJOFKIH-UHFFFAOYSA-N
XLogP0.64
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 50.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[(4,6-dimethylpyrimidin-2-yl)amino]-N-ethylacetamide?
The IUPAC name of 2-[(4,6-dimethylpyrimidin-2-yl)amino]-N-ethylacetamide (CID 43420785) is 2-[(4,6-dimethylpyrimidin-2-yl)amino]-N-ethylacetamide.
What is the SMILES notation for 2-[(4,6-dimethylpyrimidin-2-yl)amino]-N-ethylacetamide?
The canonical SMILES for 2-[(4,6-dimethylpyrimidin-2-yl)amino]-N-ethylacetamide is CCNC(=O)CNc1nc(C)cc(C)n1.
What is the InChIKey of 2-[(4,6-dimethylpyrimidin-2-yl)amino]-N-ethylacetamide?
The InChIKey is JMIUKPPUJOFKIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O/c1-4-11-9(15)6-12-10-13-7(2)5-8(3)14-10/h5H,4,6H2,1-3H3,(H,11,15)(H,12,13,14).
What are the key properties of 2-[(4,6-dimethylpyrimidin-2-yl)amino]-N-ethylacetamide?
2-[(4,6-dimethylpyrimidin-2-yl)amino]-N-ethylacetamide has a molecular weight of 208.26 g/mol, XLogP of 0.64, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4,6-dimethylpyrimidin-2-yl)amino]-N-ethylacetamide is sourced from PubChem (CID 43420785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).