N-(2-methylpropyl)-2-oxo-2-piperazin-1-ylacetamide

C10H19N3O2 — CID 28507132

IUPACN-(2-methylpropyl)-2-oxo-2-piperazin-1-ylacetamide
SMILESCC(C)CNC(=O)C(=O)N1CCNCC1
InChIInChI=1S/C10H19N3O2/c1-8(2)7-12-9(14)10(15)13-5-3-11-4-6-13/h8,11H,3-7H2,1-2H3,(H,12,14)
InChIKeyQNJWOEUSRDQIQN-UHFFFAOYSA-N
MW213.28 g/mol
LogP-0.81
Rot. Bonds2

About N-(2-methylpropyl)-2-oxo-2-piperazin-1-ylacetamide

N-(2-methylpropyl)-2-oxo-2-piperazin-1-ylacetamide (PubChem CID 28507132) has the molecular formula C10H19N3O2 and a molecular weight of 213.28 g/mol. Its IUPAC name is N-(2-methylpropyl)-2-oxo-2-piperazin-1-ylacetamide.

Molecular Properties

Compound NameN-(2-methylpropyl)-2-oxo-2-piperazin-1-ylacetamide
PubChem CID28507132
Molecular FormulaC10H19N3O2
Molecular Weight213.28 g/mol
Exact Mass213.15
IUPAC NameN-(2-methylpropyl)-2-oxo-2-piperazin-1-ylacetamide
SMILESCC(C)CNC(=O)C(=O)N1CCNCC1
InChIInChI=1S/C10H19N3O2/c1-8(2)7-12-9(14)10(15)13-5-3-11-4-6-13/h8,11H,3-7H2,1-2H3,(H,12,14)
InChIKeyQNJWOEUSRDQIQN-UHFFFAOYSA-N
XLogP-0.81
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 5-0.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Related Compounds

2-(1,4-diazepan-1-yl)-N-(2,2-difluoroethyl)-2-oxoacetamide
CID 115408222
2-oxo-2-piperazin-1-yl-N-prop-2-ynylacetamide
CID 82505400
2-(1,4-diazepan-1-yl)-N-(7-methyloctyl)-2-oxoacetamide
CID 107817508
N-butan-2-yl-2-(1,4-diazepan-1-yl)-2-oxoacetamide
CID 43145054
2-(1,4-diazepan-1-yl)-N-(2-methyl-2-methylsulfanylpropyl)-2-oxoacetamide
CID 113479277
2-(1,4-diazepan-1-yl)-N-(2-methoxy-2-methylpropyl)-2-oxoacetamide
CID 104764412
4-methyl-1-piperazin-1-ylpentan-1-one
CID 20596588
N-(2-methylpropyl)-2-[2-(piperazine-1-carbonyl)pyrrolidin-1-yl]acetamide
CID 61175724
2-oxo-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]-2-piperazin-1-ylacetamide
CID 106382993
N-octan-4-yl-2-oxo-2-piperazin-1-ylacetamide
CID 106029723
N-(2-methylpropyl)-2-oxo-2-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]acetamide
CID 108983973
N-ethylpiperazine-1-carboxamide
CID 9207783

Frequently Asked Questions

What is the IUPAC name of N-(2-methylpropyl)-2-oxo-2-piperazin-1-ylacetamide?
The IUPAC name of N-(2-methylpropyl)-2-oxo-2-piperazin-1-ylacetamide (CID 28507132) is N-(2-methylpropyl)-2-oxo-2-piperazin-1-ylacetamide.
What is the SMILES notation for N-(2-methylpropyl)-2-oxo-2-piperazin-1-ylacetamide?
The canonical SMILES for N-(2-methylpropyl)-2-oxo-2-piperazin-1-ylacetamide is CC(C)CNC(=O)C(=O)N1CCNCC1.
What is the InChIKey of N-(2-methylpropyl)-2-oxo-2-piperazin-1-ylacetamide?
The InChIKey is QNJWOEUSRDQIQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O2/c1-8(2)7-12-9(14)10(15)13-5-3-11-4-6-13/h8,11H,3-7H2,1-2H3,(H,12,14).
What are the key properties of N-(2-methylpropyl)-2-oxo-2-piperazin-1-ylacetamide?
N-(2-methylpropyl)-2-oxo-2-piperazin-1-ylacetamide has a molecular weight of 213.28 g/mol, XLogP of -0.81, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpropyl)-2-oxo-2-piperazin-1-ylacetamide is sourced from PubChem (CID 28507132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).