2-ethoxy-N-(1-pyrimidin-2-ylpiperidin-3-yl)acetamide

C13H20N4O2 — CID 60793288

IUPAC2-ethoxy-N-(1-pyrimidin-2-ylpiperidin-3-yl)acetamide
SMILESCCOCC(=O)NC1CCCN(c2ncccn2)C1
InChIInChI=1S/C13H20N4O2/c1-2-19-10-12(18)16-11-5-3-8-17(9-11)13-14-6-4-7-15-13/h4,6-7,11H,2-3,5,8-10H2,1H3,(H,16,18)
InChIKeyAIHOIOKHUMSZKW-UHFFFAOYSA-N
MW264.33 g/mol
LogP0.60
Rot. Bonds5

About 2-ethoxy-N-(1-pyrimidin-2-ylpiperidin-3-yl)acetamide

2-ethoxy-N-(1-pyrimidin-2-ylpiperidin-3-yl)acetamide (PubChem CID 60793288) has the molecular formula C13H20N4O2 and a molecular weight of 264.33 g/mol. Its IUPAC name is 2-ethoxy-N-(1-pyrimidin-2-ylpiperidin-3-yl)acetamide.

Molecular Properties

Compound Name2-ethoxy-N-(1-pyrimidin-2-ylpiperidin-3-yl)acetamide
PubChem CID60793288
Molecular FormulaC13H20N4O2
Molecular Weight264.33 g/mol
Exact Mass264.16
IUPAC Name2-ethoxy-N-(1-pyrimidin-2-ylpiperidin-3-yl)acetamide
SMILESCCOCC(=O)NC1CCCN(c2ncccn2)C1
InChIInChI=1S/C13H20N4O2/c1-2-19-10-12(18)16-11-5-3-8-17(9-11)13-14-6-4-7-15-13/h4,6-7,11H,2-3,5,8-10H2,1H3,(H,16,18)
InChIKeyAIHOIOKHUMSZKW-UHFFFAOYSA-N
XLogP0.60
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 50.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-ethoxy-N-[1-(6-pyrrolidin-1-ylpyrimidin-4-yl)piperidin-3-yl]acetamide
CID 53185796
3-methylsulfanyl-N-[(3R)-1-pyrimidin-2-ylpiperidin-3-yl]propanamide
CID 42463875
3-methylsulfanyl-N-[(3S)-1-pyrimidin-2-ylpiperidin-3-yl]propanamide
CID 42463878
2-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-N-[(3R)-1-pyrimidin-2-ylpiperidin-3-yl]acetamide
CID 95717925
(2S)-2-amino-N-(1-pyrimidin-2-ylpiperidin-3-yl)butanamide
CID 79024327
2-(4-phenylmethoxyphenoxy)-N-(1-pyrimidin-2-ylpiperidin-3-yl)acetamide
CID 55802771
2-imidazol-1-yl-N-(1-pyrimidin-2-ylpiperidin-3-yl)acetamide
CID 91835587
(2S,3S)-2-amino-3-methyl-N-(1-pyrimidin-2-ylpiperidin-3-yl)pentanamide
CID 61179360
2-(2,5-dioxoimidazolidin-1-yl)-N-[(3R)-1-pyrimidin-2-ylpiperidin-3-yl]acetamide
CID 97138600
2-[(6-methyl-1H-benzimidazol-2-yl)methoxy]-N-[(3S)-1-pyrimidin-2-ylpiperidin-3-yl]acetamide
CID 95721250
2-(1-adamantyl)-N-[(3S)-1-pyrimidin-2-ylpiperidin-3-yl]acetamide
CID 94100426
(2R)-2-amino-N-(1-pyrimidin-2-ylpiperidin-3-yl)propanamide;dihydrochloride
CID 119857933

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-(1-pyrimidin-2-ylpiperidin-3-yl)acetamide?
The IUPAC name of 2-ethoxy-N-(1-pyrimidin-2-ylpiperidin-3-yl)acetamide (CID 60793288) is 2-ethoxy-N-(1-pyrimidin-2-ylpiperidin-3-yl)acetamide.
What is the SMILES notation for 2-ethoxy-N-(1-pyrimidin-2-ylpiperidin-3-yl)acetamide?
The canonical SMILES for 2-ethoxy-N-(1-pyrimidin-2-ylpiperidin-3-yl)acetamide is CCOCC(=O)NC1CCCN(c2ncccn2)C1.
What is the InChIKey of 2-ethoxy-N-(1-pyrimidin-2-ylpiperidin-3-yl)acetamide?
The InChIKey is AIHOIOKHUMSZKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O2/c1-2-19-10-12(18)16-11-5-3-8-17(9-11)13-14-6-4-7-15-13/h4,6-7,11H,2-3,5,8-10H2,1H3,(H,16,18).
What are the key properties of 2-ethoxy-N-(1-pyrimidin-2-ylpiperidin-3-yl)acetamide?
2-ethoxy-N-(1-pyrimidin-2-ylpiperidin-3-yl)acetamide has a molecular weight of 264.33 g/mol, XLogP of 0.60, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-(1-pyrimidin-2-ylpiperidin-3-yl)acetamide is sourced from PubChem (CID 60793288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).