2-[[2-(ethylamino)pyrimidin-4-yl]-methylamino]acetamide

C9H15N5O — CID 80779125

IUPAC2-[[2-(ethylamino)pyrimidin-4-yl]-methylamino]acetamide
SMILESCCNc1nccc(N(C)CC(N)=O)n1
InChIInChI=1S/C9H15N5O/c1-3-11-9-12-5-4-8(13-9)14(2)6-7(10)15/h4-5H,3,6H2,1-2H3,(H2,10,15)(H,11,12,13)
InChIKeyQFFDOZCZFMDNNJ-UHFFFAOYSA-N
MW209.25 g/mol
LogP-0.17
Rot. Bonds5

About 2-[[2-(ethylamino)pyrimidin-4-yl]-methylamino]acetamide

2-[[2-(ethylamino)pyrimidin-4-yl]-methylamino]acetamide (PubChem CID 80779125) has the molecular formula C9H15N5O and a molecular weight of 209.25 g/mol. Its IUPAC name is 2-[[2-(ethylamino)pyrimidin-4-yl]-methylamino]acetamide.

Molecular Properties

Compound Name2-[[2-(ethylamino)pyrimidin-4-yl]-methylamino]acetamide
PubChem CID80779125
Molecular FormulaC9H15N5O
Molecular Weight209.25 g/mol
Exact Mass209.13
IUPAC Name2-[[2-(ethylamino)pyrimidin-4-yl]-methylamino]acetamide
SMILESCCNc1nccc(N(C)CC(N)=O)n1
InChIInChI=1S/C9H15N5O/c1-3-11-9-12-5-4-8(13-9)14(2)6-7(10)15/h4-5H,3,6H2,1-2H3,(H2,10,15)(H,11,12,13)
InChIKeyQFFDOZCZFMDNNJ-UHFFFAOYSA-N
XLogP-0.17
TPSA84.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 5-0.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-N-ethyl-4-N-methyl-4-N-pentylpyrimidine-2,4-diamine
CID 80783451
2-N,4-N,4-N-triethylpyrimidine-2,4-diamine
CID 80766535
2-[butyl-[2-(propylamino)pyrimidin-4-yl]amino]acetamide
CID 80821107
2-[[2-(ethylamino)pyrimidin-4-yl]-methylamino]propan-1-ol
CID 104557123
2-N-ethyl-4-N-methyl-4-N-[(2-methylcyclopropyl)methyl]pyrimidine-2,4-diamine
CID 80840076
2-N-ethyl-4-N-[(4-fluorophenyl)methyl]-4-N-methylpyrimidine-2,4-diamine
CID 80794813
2-N-ethyl-4-N-methyl-4-N-(2-phenylethyl)pyrimidine-2,4-diamine
CID 80846765
2-N-ethyl-4-N-methyl-4-N-pentan-3-ylpyrimidine-2,4-diamine
CID 80792942
3-[[2-(ethylamino)pyrimidin-4-yl]amino]propanamide
CID 80787264
2-N-ethyl-4-N-[(4-methoxyphenyl)methyl]-4-N-methylpyrimidine-2,4-diamine
CID 80794622
2-[(2-aminopyrimidin-4-yl)-methylamino]-N-ethylacetamide
CID 80805134
2-[methyl-(4-methyl-2-pyridinyl)amino]acetamide
CID 130650937

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(ethylamino)pyrimidin-4-yl]-methylamino]acetamide?
The IUPAC name of 2-[[2-(ethylamino)pyrimidin-4-yl]-methylamino]acetamide (CID 80779125) is 2-[[2-(ethylamino)pyrimidin-4-yl]-methylamino]acetamide.
What is the SMILES notation for 2-[[2-(ethylamino)pyrimidin-4-yl]-methylamino]acetamide?
The canonical SMILES for 2-[[2-(ethylamino)pyrimidin-4-yl]-methylamino]acetamide is CCNc1nccc(N(C)CC(N)=O)n1.
What is the InChIKey of 2-[[2-(ethylamino)pyrimidin-4-yl]-methylamino]acetamide?
The InChIKey is QFFDOZCZFMDNNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N5O/c1-3-11-9-12-5-4-8(13-9)14(2)6-7(10)15/h4-5H,3,6H2,1-2H3,(H2,10,15)(H,11,12,13).
What are the key properties of 2-[[2-(ethylamino)pyrimidin-4-yl]-methylamino]acetamide?
2-[[2-(ethylamino)pyrimidin-4-yl]-methylamino]acetamide has a molecular weight of 209.25 g/mol, XLogP of -0.17, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(ethylamino)pyrimidin-4-yl]-methylamino]acetamide is sourced from PubChem (CID 80779125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).