2-[2-[(2-methylpyrimidin-4-yl)methylamino]ethoxy]acetamide

C10H16N4O2 — CID 106236339

IUPAC2-[2-[(2-methylpyrimidin-4-yl)methylamino]ethoxy]acetamide
SMILESCc1nccc(CNCCOCC(N)=O)n1
InChIInChI=1S/C10H16N4O2/c1-8-13-3-2-9(14-8)6-12-4-5-16-7-10(11)15/h2-3,12H,4-7H2,1H3,(H2,11,15)
InChIKeyUJMDVRQXTODJKE-UHFFFAOYSA-N
MW224.26 g/mol
LogP-0.62
Rot. Bonds7

About 2-[2-[(2-methylpyrimidin-4-yl)methylamino]ethoxy]acetamide

2-[2-[(2-methylpyrimidin-4-yl)methylamino]ethoxy]acetamide (PubChem CID 106236339) has the molecular formula C10H16N4O2 and a molecular weight of 224.26 g/mol. Its IUPAC name is 2-[2-[(2-methylpyrimidin-4-yl)methylamino]ethoxy]acetamide.

Molecular Properties

Compound Name2-[2-[(2-methylpyrimidin-4-yl)methylamino]ethoxy]acetamide
PubChem CID106236339
Molecular FormulaC10H16N4O2
Molecular Weight224.26 g/mol
Exact Mass224.13
IUPAC Name2-[2-[(2-methylpyrimidin-4-yl)methylamino]ethoxy]acetamide
SMILESCc1nccc(CNCCOCC(N)=O)n1
InChIInChI=1S/C10H16N4O2/c1-8-13-3-2-9(14-8)6-12-4-5-16-7-10(11)15/h2-3,12H,4-7H2,1H3,(H2,11,15)
InChIKeyUJMDVRQXTODJKE-UHFFFAOYSA-N
XLogP-0.62
TPSA90.13 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 5-0.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-[(2-methylpyrimidin-4-yl)methylamino]ethyl carbamate
CID 83211810
2-(2-methylprop-2-enoxy)-N-[(2-methylpyrimidin-4-yl)methyl]ethanamine
CID 114465996
N-[(2-methylpyrimidin-4-yl)methyl]-2-propoxyethanamine
CID 106451723
N-[(2-methylpyrimidin-4-yl)methyl]propan-1-amine
CID 46785088
2-but-3-enoxy-N-[(2-methylpyrimidin-4-yl)methyl]ethanamine
CID 106397557
2-[2-[(2-methyl-1,3-thiazol-4-yl)methylamino]ethoxy]acetamide
CID 106235728
2-[2-[(3-methyl-2-pyridinyl)methylamino]ethoxy]acetamide
CID 106238176
2-(2-aminoethoxy)-N-[(2-methylpyrimidin-4-yl)methyl]acetamide
CID 79474047
N'-hydroxy-2-[2-[(2-methylpyrimidin-4-yl)methylamino]ethoxy]propanimidamide
CID 114266326
N-methyl-3-[(2-methylpyrimidin-4-yl)methylamino]propanamide
CID 62326409
2-hydroxy-3-[(2-methylpyrimidin-4-yl)methylamino]propanamide
CID 106171849
N'-hydroxy-3-[(2-methylpyrimidin-4-yl)methylamino]propanimidamide
CID 77030166

Frequently Asked Questions

What is the IUPAC name of 2-[2-[(2-methylpyrimidin-4-yl)methylamino]ethoxy]acetamide?
The IUPAC name of 2-[2-[(2-methylpyrimidin-4-yl)methylamino]ethoxy]acetamide (CID 106236339) is 2-[2-[(2-methylpyrimidin-4-yl)methylamino]ethoxy]acetamide.
What is the SMILES notation for 2-[2-[(2-methylpyrimidin-4-yl)methylamino]ethoxy]acetamide?
The canonical SMILES for 2-[2-[(2-methylpyrimidin-4-yl)methylamino]ethoxy]acetamide is Cc1nccc(CNCCOCC(N)=O)n1.
What is the InChIKey of 2-[2-[(2-methylpyrimidin-4-yl)methylamino]ethoxy]acetamide?
The InChIKey is UJMDVRQXTODJKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O2/c1-8-13-3-2-9(14-8)6-12-4-5-16-7-10(11)15/h2-3,12H,4-7H2,1H3,(H2,11,15).
What are the key properties of 2-[2-[(2-methylpyrimidin-4-yl)methylamino]ethoxy]acetamide?
2-[2-[(2-methylpyrimidin-4-yl)methylamino]ethoxy]acetamide has a molecular weight of 224.26 g/mol, XLogP of -0.62, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[(2-methylpyrimidin-4-yl)methylamino]ethoxy]acetamide is sourced from PubChem (CID 106236339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).