ethyl 2-[methyl-(4-methylpyrimidin-2-yl)amino]acetate

C10H15N3O2 — CID 62958932

IUPACethyl 2-[methyl-(4-methylpyrimidin-2-yl)amino]acetate
SMILESCCOC(=O)CN(C)c1nccc(C)n1
InChIInChI=1S/C10H15N3O2/c1-4-15-9(14)7-13(3)10-11-6-5-8(2)12-10/h5-6H,4,7H2,1-3H3
InChIKeyHZAVNSIWTIYZAH-UHFFFAOYSA-N
MW209.25 g/mol
LogP0.78
Rot. Bonds4

About ethyl 2-[methyl-(4-methylpyrimidin-2-yl)amino]acetate

ethyl 2-[methyl-(4-methylpyrimidin-2-yl)amino]acetate (PubChem CID 62958932) has the molecular formula C10H15N3O2 and a molecular weight of 209.25 g/mol. Its IUPAC name is ethyl 2-[methyl-(4-methylpyrimidin-2-yl)amino]acetate.

Molecular Properties

Compound Nameethyl 2-[methyl-(4-methylpyrimidin-2-yl)amino]acetate
PubChem CID62958932
Molecular FormulaC10H15N3O2
Molecular Weight209.25 g/mol
Exact Mass209.12
IUPAC Nameethyl 2-[methyl-(4-methylpyrimidin-2-yl)amino]acetate
SMILESCCOC(=O)CN(C)c1nccc(C)n1
InChIInChI=1S/C10H15N3O2/c1-4-15-9(14)7-13(3)10-11-6-5-8(2)12-10/h5-6H,4,7H2,1-3H3
InChIKeyHZAVNSIWTIYZAH-UHFFFAOYSA-N
XLogP0.78
TPSA55.32 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 50.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

ethyl 2-[(4-cyanopyrimidin-2-yl)-methylamino]acetate
CID 107544034
1-[methyl-(4-methylpyrimidin-2-yl)amino]propan-2-one
CID 117044761
ethyl 2-[(4-carbamothioyl-6-methylpyrimidin-2-yl)-methylamino]acetate
CID 107546994
ethyl 2-[(5-tert-butylpyrimidin-2-yl)-methylamino]acetate
CID 58333113
ethyl 2-[[2-(dimethylcarbamoyl)-4-pyridinyl]-methylamino]acetate
CID 62005214
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CID 62007331
2-[(4-aminopyrimidin-2-yl)-methylamino]-N,N-diethylacetamide
CID 115978158
ethyl 2-[(2-cyano-4-pyridinyl)-methylamino]acetate
CID 55210694
ethyl 2-[ethyl-(4-methoxypyrimidin-2-yl)amino]acetate
CID 62004945
ethyl 2-[(3-chloro-2-pyridinyl)-methylamino]acetate
CID 62006591
ethyl 4-[2-[2-[methyl(pyrimidin-2-yl)amino]acetyl]oxyacetyl]piperazine-1-carboxylate
CID 43067977
1-N-methyl-1-N-(4-methylpyrimidin-2-yl)propane-1,2-diamine
CID 63761938

Frequently Asked Questions

What is the IUPAC name of ethyl 2-[methyl-(4-methylpyrimidin-2-yl)amino]acetate?
The IUPAC name of ethyl 2-[methyl-(4-methylpyrimidin-2-yl)amino]acetate (CID 62958932) is ethyl 2-[methyl-(4-methylpyrimidin-2-yl)amino]acetate.
What is the SMILES notation for ethyl 2-[methyl-(4-methylpyrimidin-2-yl)amino]acetate?
The canonical SMILES for ethyl 2-[methyl-(4-methylpyrimidin-2-yl)amino]acetate is CCOC(=O)CN(C)c1nccc(C)n1.
What is the InChIKey of ethyl 2-[methyl-(4-methylpyrimidin-2-yl)amino]acetate?
The InChIKey is HZAVNSIWTIYZAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2/c1-4-15-9(14)7-13(3)10-11-6-5-8(2)12-10/h5-6H,4,7H2,1-3H3.
What are the key properties of ethyl 2-[methyl-(4-methylpyrimidin-2-yl)amino]acetate?
ethyl 2-[methyl-(4-methylpyrimidin-2-yl)amino]acetate has a molecular weight of 209.25 g/mol, XLogP of 0.78, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-[methyl-(4-methylpyrimidin-2-yl)amino]acetate is sourced from PubChem (CID 62958932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).