2-amino-N,2-dimethyl-N-(2-oxo-2-piperazin-1-ylethyl)propanamide

C11H22N4O2 — CID 82511586

IUPAC2-amino-N,2-dimethyl-N-(2-oxo-2-piperazin-1-ylethyl)propanamide
SMILESCN(CC(=O)N1CCNCC1)C(=O)C(C)(C)N
InChIInChI=1S/C11H22N4O2/c1-11(2,12)10(17)14(3)8-9(16)15-6-4-13-5-7-15/h13H,4-8,12H2,1-3H3
InChIKeyRQCPDTBUHANLQN-UHFFFAOYSA-N
MW242.32 g/mol
LogP-1.39
Rot. Bonds3

About 2-amino-N,2-dimethyl-N-(2-oxo-2-piperazin-1-ylethyl)propanamide

2-amino-N,2-dimethyl-N-(2-oxo-2-piperazin-1-ylethyl)propanamide (PubChem CID 82511586) has the molecular formula C11H22N4O2 and a molecular weight of 242.32 g/mol. Its IUPAC name is 2-amino-N,2-dimethyl-N-(2-oxo-2-piperazin-1-ylethyl)propanamide.

Molecular Properties

Compound Name2-amino-N,2-dimethyl-N-(2-oxo-2-piperazin-1-ylethyl)propanamide
PubChem CID82511586
Molecular FormulaC11H22N4O2
Molecular Weight242.32 g/mol
Exact Mass242.17
IUPAC Name2-amino-N,2-dimethyl-N-(2-oxo-2-piperazin-1-ylethyl)propanamide
SMILESCN(CC(=O)N1CCNCC1)C(=O)C(C)(C)N
InChIInChI=1S/C11H22N4O2/c1-11(2,12)10(17)14(3)8-9(16)15-6-4-13-5-7-15/h13H,4-8,12H2,1-3H3
InChIKeyRQCPDTBUHANLQN-UHFFFAOYSA-N
XLogP-1.39
TPSA78.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 5-1.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N,2-dimethyl-N-(2-oxo-2-piperazin-1-ylethyl)propanamide?
The IUPAC name of 2-amino-N,2-dimethyl-N-(2-oxo-2-piperazin-1-ylethyl)propanamide (CID 82511586) is 2-amino-N,2-dimethyl-N-(2-oxo-2-piperazin-1-ylethyl)propanamide.
What is the SMILES notation for 2-amino-N,2-dimethyl-N-(2-oxo-2-piperazin-1-ylethyl)propanamide?
The canonical SMILES for 2-amino-N,2-dimethyl-N-(2-oxo-2-piperazin-1-ylethyl)propanamide is CN(CC(=O)N1CCNCC1)C(=O)C(C)(C)N.
What is the InChIKey of 2-amino-N,2-dimethyl-N-(2-oxo-2-piperazin-1-ylethyl)propanamide?
The InChIKey is RQCPDTBUHANLQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N4O2/c1-11(2,12)10(17)14(3)8-9(16)15-6-4-13-5-7-15/h13H,4-8,12H2,1-3H3.
What are the key properties of 2-amino-N,2-dimethyl-N-(2-oxo-2-piperazin-1-ylethyl)propanamide?
2-amino-N,2-dimethyl-N-(2-oxo-2-piperazin-1-ylethyl)propanamide has a molecular weight of 242.32 g/mol, XLogP of -1.39, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N,2-dimethyl-N-(2-oxo-2-piperazin-1-ylethyl)propanamide is sourced from PubChem (CID 82511586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).