2-methyl-N-(1-oxo-1-piperazin-1-ylpropan-2-yl)propanamide

C11H21N3O2 — CID 82020267

IUPAC2-methyl-N-(1-oxo-1-piperazin-1-ylpropan-2-yl)propanamide
SMILESCC(C)C(=O)NC(C)C(=O)N1CCNCC1
InChIInChI=1S/C11H21N3O2/c1-8(2)10(15)13-9(3)11(16)14-6-4-12-5-7-14/h8-9,12H,4-7H2,1-3H3,(H,13,15)
InChIKeyKOYQCTIMXOREMZ-UHFFFAOYSA-N
MW227.31 g/mol
LogP-0.42
Rot. Bonds3

About 2-methyl-N-(1-oxo-1-piperazin-1-ylpropan-2-yl)propanamide

2-methyl-N-(1-oxo-1-piperazin-1-ylpropan-2-yl)propanamide (PubChem CID 82020267) has the molecular formula C11H21N3O2 and a molecular weight of 227.31 g/mol. Its IUPAC name is 2-methyl-N-(1-oxo-1-piperazin-1-ylpropan-2-yl)propanamide.

Molecular Properties

Compound Name2-methyl-N-(1-oxo-1-piperazin-1-ylpropan-2-yl)propanamide
PubChem CID82020267
Molecular FormulaC11H21N3O2
Molecular Weight227.31 g/mol
Exact Mass227.16
IUPAC Name2-methyl-N-(1-oxo-1-piperazin-1-ylpropan-2-yl)propanamide
SMILESCC(C)C(=O)NC(C)C(=O)N1CCNCC1
InChIInChI=1S/C11H21N3O2/c1-8(2)10(15)13-9(3)11(16)14-6-4-12-5-7-14/h8-9,12H,4-7H2,1-3H3,(H,13,15)
InChIKeyKOYQCTIMXOREMZ-UHFFFAOYSA-N
XLogP-0.42
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 5-0.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-methyl-N-(1-oxo-1-piperazin-1-ylpropan-2-yl)propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-methyl-N-(1-oxo-1-piperazin-1-ylpropan-2-yl)but-2-enamide
CID 82511161
2-methyl-N-(3-oxo-3-piperazin-1-ylpropyl)propanamide
CID 28709201
N-[2-(dimethylamino)ethyl]-2-methylpropanamide;methane;2-methyl-1-piperazin-1-ylpropan-1-one
CID 159310071
(2R)-2-(piperazine-1-carbonylamino)propanoic acid
CID 78972178
1-piperazin-1-yl-2-(pyrimidin-2-ylamino)propan-1-one
CID 82510577
(2S)-2,3,3-trimethyl-1-piperazin-1-ylbutan-1-one
CID 59979591
4-chloro-N-[1-(1,4-diazepan-1-yl)-1-oxopropan-2-yl]benzamide;hydrochloride
CID 119418273
2-cyclohexyl-N-[1-(1,4-diazepan-1-yl)-1-oxopropan-2-yl]acetamide;hydrochloride
CID 119418106
benzyl N-[(2S)-1-oxo-1-piperazin-1-ylpropan-2-yl]carbamate
CID 93481132
(2S)-3-methoxy-2-methyl-1-piperazin-1-ylpropan-1-one
CID 96682051
2,2-dimethyl-N-(3-methyl-1-oxo-1-piperazin-1-ylbutan-2-yl)propanamide
CID 82020291
2-(dimethylamino)-3-methyl-1-piperazin-1-ylbutan-1-one
CID 82508777

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(1-oxo-1-piperazin-1-ylpropan-2-yl)propanamide?
The IUPAC name of 2-methyl-N-(1-oxo-1-piperazin-1-ylpropan-2-yl)propanamide (CID 82020267) is 2-methyl-N-(1-oxo-1-piperazin-1-ylpropan-2-yl)propanamide.
What is the SMILES notation for 2-methyl-N-(1-oxo-1-piperazin-1-ylpropan-2-yl)propanamide?
The canonical SMILES for 2-methyl-N-(1-oxo-1-piperazin-1-ylpropan-2-yl)propanamide is CC(C)C(=O)NC(C)C(=O)N1CCNCC1.
What is the InChIKey of 2-methyl-N-(1-oxo-1-piperazin-1-ylpropan-2-yl)propanamide?
The InChIKey is KOYQCTIMXOREMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O2/c1-8(2)10(15)13-9(3)11(16)14-6-4-12-5-7-14/h8-9,12H,4-7H2,1-3H3,(H,13,15).
What are the key properties of 2-methyl-N-(1-oxo-1-piperazin-1-ylpropan-2-yl)propanamide?
2-methyl-N-(1-oxo-1-piperazin-1-ylpropan-2-yl)propanamide has a molecular weight of 227.31 g/mol, XLogP of -0.42, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(1-oxo-1-piperazin-1-ylpropan-2-yl)propanamide is sourced from PubChem (CID 82020267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).