N-ethyl-2-[(4-methoxypyrimidin-2-yl)amino]acetamide

C9H14N4O2 — CID 75413298

IUPACN-ethyl-2-[(4-methoxypyrimidin-2-yl)amino]acetamide
SMILESCCNC(=O)CNc1nccc(OC)n1
InChIInChI=1S/C9H14N4O2/c1-3-10-7(14)6-12-9-11-5-4-8(13-9)15-2/h4-5H,3,6H2,1-2H3,(H,10,14)(H,11,12,13)
InChIKeyGDCANOJQFIDSCO-UHFFFAOYSA-N
MW210.24 g/mol
LogP0.03
Rot. Bonds5

About N-ethyl-2-[(4-methoxypyrimidin-2-yl)amino]acetamide

N-ethyl-2-[(4-methoxypyrimidin-2-yl)amino]acetamide (PubChem CID 75413298) has the molecular formula C9H14N4O2 and a molecular weight of 210.24 g/mol. Its IUPAC name is N-ethyl-2-[(4-methoxypyrimidin-2-yl)amino]acetamide.

Molecular Properties

Compound NameN-ethyl-2-[(4-methoxypyrimidin-2-yl)amino]acetamide
PubChem CID75413298
Molecular FormulaC9H14N4O2
Molecular Weight210.24 g/mol
Exact Mass210.11
IUPAC NameN-ethyl-2-[(4-methoxypyrimidin-2-yl)amino]acetamide
SMILESCCNC(=O)CNc1nccc(OC)n1
InChIInChI=1S/C9H14N4O2/c1-3-10-7(14)6-12-9-11-5-4-8(13-9)15-2/h4-5H,3,6H2,1-2H3,(H,10,14)(H,11,12,13)
InChIKeyGDCANOJQFIDSCO-UHFFFAOYSA-N
XLogP0.03
TPSA76.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.24
LogP ≤ 50.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[(4-methoxypyrimidin-2-yl)amino]acetamide?
The IUPAC name of N-ethyl-2-[(4-methoxypyrimidin-2-yl)amino]acetamide (CID 75413298) is N-ethyl-2-[(4-methoxypyrimidin-2-yl)amino]acetamide.
What is the SMILES notation for N-ethyl-2-[(4-methoxypyrimidin-2-yl)amino]acetamide?
The canonical SMILES for N-ethyl-2-[(4-methoxypyrimidin-2-yl)amino]acetamide is CCNC(=O)CNc1nccc(OC)n1.
What is the InChIKey of N-ethyl-2-[(4-methoxypyrimidin-2-yl)amino]acetamide?
The InChIKey is GDCANOJQFIDSCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N4O2/c1-3-10-7(14)6-12-9-11-5-4-8(13-9)15-2/h4-5H,3,6H2,1-2H3,(H,10,14)(H,11,12,13).
What are the key properties of N-ethyl-2-[(4-methoxypyrimidin-2-yl)amino]acetamide?
N-ethyl-2-[(4-methoxypyrimidin-2-yl)amino]acetamide has a molecular weight of 210.24 g/mol, XLogP of 0.03, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[(4-methoxypyrimidin-2-yl)amino]acetamide is sourced from PubChem (CID 75413298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).