2-[ethyl(piperidin-1-ylcarbamoyl)amino]acetic acid

C10H19N3O3 — CID 83019494

IUPAC2-[ethyl(piperidin-1-ylcarbamoyl)amino]acetic acid
SMILESCCN(CC(=O)O)C(=O)NN1CCCCC1
InChIInChI=1S/C10H19N3O3/c1-2-12(8-9(14)15)10(16)11-13-6-4-3-5-7-13/h2-8H2,1H3,(H,11,16)(H,14,15)
InChIKeyFEYHSGWERFUPJS-UHFFFAOYSA-N
MW229.28 g/mol
LogP0.50
Rot. Bonds4

About 2-[ethyl(piperidin-1-ylcarbamoyl)amino]acetic acid

2-[ethyl(piperidin-1-ylcarbamoyl)amino]acetic acid (PubChem CID 83019494) has the molecular formula C10H19N3O3 and a molecular weight of 229.28 g/mol. Its IUPAC name is 2-[ethyl(piperidin-1-ylcarbamoyl)amino]acetic acid.

Molecular Properties

Compound Name2-[ethyl(piperidin-1-ylcarbamoyl)amino]acetic acid
PubChem CID83019494
Molecular FormulaC10H19N3O3
Molecular Weight229.28 g/mol
Exact Mass229.14
IUPAC Name2-[ethyl(piperidin-1-ylcarbamoyl)amino]acetic acid
SMILESCCN(CC(=O)O)C(=O)NN1CCCCC1
InChIInChI=1S/C10H19N3O3/c1-2-12(8-9(14)15)10(16)11-13-6-4-3-5-7-13/h2-8H2,1H3,(H,11,16)(H,14,15)
InChIKeyFEYHSGWERFUPJS-UHFFFAOYSA-N
XLogP0.50
TPSA72.88 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 50.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[ethyl(piperidin-1-ylcarbamoyl)amino]acetic acid?
The IUPAC name of 2-[ethyl(piperidin-1-ylcarbamoyl)amino]acetic acid (CID 83019494) is 2-[ethyl(piperidin-1-ylcarbamoyl)amino]acetic acid.
What is the SMILES notation for 2-[ethyl(piperidin-1-ylcarbamoyl)amino]acetic acid?
The canonical SMILES for 2-[ethyl(piperidin-1-ylcarbamoyl)amino]acetic acid is CCN(CC(=O)O)C(=O)NN1CCCCC1.
What is the InChIKey of 2-[ethyl(piperidin-1-ylcarbamoyl)amino]acetic acid?
The InChIKey is FEYHSGWERFUPJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O3/c1-2-12(8-9(14)15)10(16)11-13-6-4-3-5-7-13/h2-8H2,1H3,(H,11,16)(H,14,15).
What are the key properties of 2-[ethyl(piperidin-1-ylcarbamoyl)amino]acetic acid?
2-[ethyl(piperidin-1-ylcarbamoyl)amino]acetic acid has a molecular weight of 229.28 g/mol, XLogP of 0.50, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl(piperidin-1-ylcarbamoyl)amino]acetic acid is sourced from PubChem (CID 83019494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).