2-[(2-oxo-2-piperidin-1-ylethyl)amino]-N-propan-2-ylacetamide

C12H23N3O2 — CID 43402015

IUPAC2-[(2-oxo-2-piperidin-1-ylethyl)amino]-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)CNCC(=O)N1CCCCC1
InChIInChI=1S/C12H23N3O2/c1-10(2)14-11(16)8-13-9-12(17)15-6-4-3-5-7-15/h10,13H,3-9H2,1-2H3,(H,14,16)
InChIKeyBJUFFPZVCRZREF-UHFFFAOYSA-N
MW241.33 g/mol
LogP0.11
Rot. Bonds5

About 2-[(2-oxo-2-piperidin-1-ylethyl)amino]-N-propan-2-ylacetamide

2-[(2-oxo-2-piperidin-1-ylethyl)amino]-N-propan-2-ylacetamide (PubChem CID 43402015) has the molecular formula C12H23N3O2 and a molecular weight of 241.33 g/mol. Its IUPAC name is 2-[(2-oxo-2-piperidin-1-ylethyl)amino]-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-[(2-oxo-2-piperidin-1-ylethyl)amino]-N-propan-2-ylacetamide
PubChem CID43402015
Molecular FormulaC12H23N3O2
Molecular Weight241.33 g/mol
Exact Mass241.18
IUPAC Name2-[(2-oxo-2-piperidin-1-ylethyl)amino]-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)CNCC(=O)N1CCCCC1
InChIInChI=1S/C12H23N3O2/c1-10(2)14-11(16)8-13-9-12(17)15-6-4-3-5-7-15/h10,13H,3-9H2,1-2H3,(H,14,16)
InChIKeyBJUFFPZVCRZREF-UHFFFAOYSA-N
XLogP0.11
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 50.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(2-oxo-2-piperidin-1-ylethyl)amino]-N-propan-2-ylacetamide?
The IUPAC name of 2-[(2-oxo-2-piperidin-1-ylethyl)amino]-N-propan-2-ylacetamide (CID 43402015) is 2-[(2-oxo-2-piperidin-1-ylethyl)amino]-N-propan-2-ylacetamide.
What is the SMILES notation for 2-[(2-oxo-2-piperidin-1-ylethyl)amino]-N-propan-2-ylacetamide?
The canonical SMILES for 2-[(2-oxo-2-piperidin-1-ylethyl)amino]-N-propan-2-ylacetamide is CC(C)NC(=O)CNCC(=O)N1CCCCC1.
What is the InChIKey of 2-[(2-oxo-2-piperidin-1-ylethyl)amino]-N-propan-2-ylacetamide?
The InChIKey is BJUFFPZVCRZREF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O2/c1-10(2)14-11(16)8-13-9-12(17)15-6-4-3-5-7-15/h10,13H,3-9H2,1-2H3,(H,14,16).
What are the key properties of 2-[(2-oxo-2-piperidin-1-ylethyl)amino]-N-propan-2-ylacetamide?
2-[(2-oxo-2-piperidin-1-ylethyl)amino]-N-propan-2-ylacetamide has a molecular weight of 241.33 g/mol, XLogP of 0.11, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-oxo-2-piperidin-1-ylethyl)amino]-N-propan-2-ylacetamide is sourced from PubChem (CID 43402015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).