N-methyl-N-(2-piperazin-1-ylethyl)pyrrolidine-1-carboxamide

C12H24N4O — CID 79161541

IUPACN-methyl-N-(2-piperazin-1-ylethyl)pyrrolidine-1-carboxamide
SMILESCN(CCN1CCNCC1)C(=O)N1CCCC1
InChIInChI=1S/C12H24N4O/c1-14(12(17)16-6-2-3-7-16)10-11-15-8-4-13-5-9-15/h13H,2-11H2,1H3
InChIKeyXLEOAXZQAFULDA-UHFFFAOYSA-N
MW240.35 g/mol
LogP0.04
Rot. Bonds3

About N-methyl-N-(2-piperazin-1-ylethyl)pyrrolidine-1-carboxamide

N-methyl-N-(2-piperazin-1-ylethyl)pyrrolidine-1-carboxamide (PubChem CID 79161541) has the molecular formula C12H24N4O and a molecular weight of 240.35 g/mol. Its IUPAC name is N-methyl-N-(2-piperazin-1-ylethyl)pyrrolidine-1-carboxamide.

Molecular Properties

Compound NameN-methyl-N-(2-piperazin-1-ylethyl)pyrrolidine-1-carboxamide
PubChem CID79161541
Molecular FormulaC12H24N4O
Molecular Weight240.35 g/mol
Exact Mass240.20
IUPAC NameN-methyl-N-(2-piperazin-1-ylethyl)pyrrolidine-1-carboxamide
SMILESCN(CCN1CCNCC1)C(=O)N1CCCC1
InChIInChI=1S/C12H24N4O/c1-14(12(17)16-6-2-3-7-16)10-11-15-8-4-13-5-9-15/h13H,2-11H2,1H3
InChIKeyXLEOAXZQAFULDA-UHFFFAOYSA-N
XLogP0.04
TPSA38.82 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 50.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,2-dimethyl-N-(2-piperazin-1-ylethyl)propanamide
CID 63265503
N-methyl-2-oxo-2-piperazin-1-yl-N-(2-pyrrolidin-1-ylethyl)acetamide
CID 63209113
N-methyl-N-(2-piperazin-1-ylethyl)hex-5-ynamide
CID 90191014
N-methyl-N-(2-piperazin-1-ylethyl)oxolane-3-carboxamide
CID 63265616
(2S)-N-methyl-N-(2-piperazin-1-ylethyl)oxolane-2-carboxamide
CID 104856250
N-methyl-N-(2-piperazin-1-ylethyl)oxolane-2-carboxamide
CID 63265290
N-methyl-N-(2-piperazin-1-ylethyl)benzamide
CID 63265460
N-(2-hydroxyethyl)-N-methylpiperidine-1-carboxamide
CID 68606002
N-(3-aminopropyl)-N-methylpyrrolidine-1-carboxamide
CID 79160813
2,3-dichloro-N-methyl-N-(2-piperazin-1-ylethyl)benzamide
CID 63265748
N-[2-[(3S,4R)-4-amino-3-hydroxypiperidin-1-yl]ethyl]-N-methylpyrrolidine-1-carboxamide
CID 15078451
N-methyl-N-(2-piperazin-1-ylethyl)pyridine-4-carboxamide
CID 63265506

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(2-piperazin-1-ylethyl)pyrrolidine-1-carboxamide?
The IUPAC name of N-methyl-N-(2-piperazin-1-ylethyl)pyrrolidine-1-carboxamide (CID 79161541) is N-methyl-N-(2-piperazin-1-ylethyl)pyrrolidine-1-carboxamide.
What is the SMILES notation for N-methyl-N-(2-piperazin-1-ylethyl)pyrrolidine-1-carboxamide?
The canonical SMILES for N-methyl-N-(2-piperazin-1-ylethyl)pyrrolidine-1-carboxamide is CN(CCN1CCNCC1)C(=O)N1CCCC1.
What is the InChIKey of N-methyl-N-(2-piperazin-1-ylethyl)pyrrolidine-1-carboxamide?
The InChIKey is XLEOAXZQAFULDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N4O/c1-14(12(17)16-6-2-3-7-16)10-11-15-8-4-13-5-9-15/h13H,2-11H2,1H3.
What are the key properties of N-methyl-N-(2-piperazin-1-ylethyl)pyrrolidine-1-carboxamide?
N-methyl-N-(2-piperazin-1-ylethyl)pyrrolidine-1-carboxamide has a molecular weight of 240.35 g/mol, XLogP of 0.04, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(2-piperazin-1-ylethyl)pyrrolidine-1-carboxamide is sourced from PubChem (CID 79161541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).