N,N-dimethyl-1-(5-oxopyrrolidine-3-carbonyl)piperazine-2-carboxamide

C12H20N4O3 — CID 83191600

IUPACN,N-dimethyl-1-(5-oxopyrrolidine-3-carbonyl)piperazine-2-carboxamide
SMILESCN(C)C(=O)C1CNCCN1C(=O)C1CNC(=O)C1
InChIInChI=1S/C12H20N4O3/c1-15(2)12(19)9-7-13-3-4-16(9)11(18)8-5-10(17)14-6-8/h8-9,13H,3-7H2,1-2H3,(H,14,17)
InChIKeyZTNDIFOAKZLNAC-UHFFFAOYSA-N
MW268.32 g/mol
LogP-1.99
Rot. Bonds2

About N,N-dimethyl-1-(5-oxopyrrolidine-3-carbonyl)piperazine-2-carboxamide

N,N-dimethyl-1-(5-oxopyrrolidine-3-carbonyl)piperazine-2-carboxamide (PubChem CID 83191600) has the molecular formula C12H20N4O3 and a molecular weight of 268.32 g/mol. Its IUPAC name is N,N-dimethyl-1-(5-oxopyrrolidine-3-carbonyl)piperazine-2-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-1-(5-oxopyrrolidine-3-carbonyl)piperazine-2-carboxamide
PubChem CID83191600
Molecular FormulaC12H20N4O3
Molecular Weight268.32 g/mol
Exact Mass268.15
IUPAC NameN,N-dimethyl-1-(5-oxopyrrolidine-3-carbonyl)piperazine-2-carboxamide
SMILESCN(C)C(=O)C1CNCCN1C(=O)C1CNC(=O)C1
InChIInChI=1S/C12H20N4O3/c1-15(2)12(19)9-7-13-3-4-16(9)11(18)8-5-10(17)14-6-8/h8-9,13H,3-7H2,1-2H3,(H,14,17)
InChIKeyZTNDIFOAKZLNAC-UHFFFAOYSA-N
XLogP-1.99
TPSA81.75 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 5-1.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-1-(5-oxopyrrolidine-3-carbonyl)piperazine-2-carboxamide
CID 83193491
4-(2-methylpiperazine-1-carbonyl)pyrrolidin-2-one;hydrochloride
CID 119473611
(2S)-1-acetyl-N,N-dimethylpiperazine-2-carboxamide
CID 95804037
N,N-dimethyl-1-(5-methyloxolane-3-carbonyl)piperazine-2-carboxamide
CID 114826425
N-ethyl-1-(6-oxopiperidine-3-carbonyl)piperazine-2-carboxamide
CID 83191736
5-[(2R)-2-methylpiperazine-1-carbonyl]piperidin-2-one
CID 82705832
N-methyl-1-(5-oxopyrrolidine-3-carbonyl)piperidine-2-carboxamide
CID 78983261
N,N-dimethyl-1-(5-methylfuran-3-carbonyl)piperazine-2-carboxamide
CID 114822004
N,N-dimethyl-1-(3-methylpiperidine-1-carbonyl)piperazine-2-carboxamide
CID 79163292
1-(4-hydroxy-3-methylbenzoyl)-N,N-dimethylpiperazine-2-carboxamide
CID 107672122
1-(3-chloro-5-methylbenzoyl)-N,N-dimethylpiperazine-2-carboxamide
CID 81315811
4-(5-oxopyrrolidine-3-carbonyl)morpholine-3-carboxamide
CID 83093489

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-(5-oxopyrrolidine-3-carbonyl)piperazine-2-carboxamide?
The IUPAC name of N,N-dimethyl-1-(5-oxopyrrolidine-3-carbonyl)piperazine-2-carboxamide (CID 83191600) is N,N-dimethyl-1-(5-oxopyrrolidine-3-carbonyl)piperazine-2-carboxamide.
What is the SMILES notation for N,N-dimethyl-1-(5-oxopyrrolidine-3-carbonyl)piperazine-2-carboxamide?
The canonical SMILES for N,N-dimethyl-1-(5-oxopyrrolidine-3-carbonyl)piperazine-2-carboxamide is CN(C)C(=O)C1CNCCN1C(=O)C1CNC(=O)C1.
What is the InChIKey of N,N-dimethyl-1-(5-oxopyrrolidine-3-carbonyl)piperazine-2-carboxamide?
The InChIKey is ZTNDIFOAKZLNAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O3/c1-15(2)12(19)9-7-13-3-4-16(9)11(18)8-5-10(17)14-6-8/h8-9,13H,3-7H2,1-2H3,(H,14,17).
What are the key properties of N,N-dimethyl-1-(5-oxopyrrolidine-3-carbonyl)piperazine-2-carboxamide?
N,N-dimethyl-1-(5-oxopyrrolidine-3-carbonyl)piperazine-2-carboxamide has a molecular weight of 268.32 g/mol, XLogP of -1.99, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-(5-oxopyrrolidine-3-carbonyl)piperazine-2-carboxamide is sourced from PubChem (CID 83191600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).