5-oxo-1-(2-piperazin-1-ylethyl)pyrrolidine-3-carboxamide

C11H20N4O2 — CID 168697234

IUPAC5-oxo-1-(2-piperazin-1-ylethyl)pyrrolidine-3-carboxamide
SMILESNC(=O)C1CC(=O)N(CCN2CCNCC2)C1
InChIInChI=1S/C11H20N4O2/c12-11(17)9-7-10(16)15(8-9)6-5-14-3-1-13-2-4-14/h9,13H,1-8H2,(H2,12,17)
InChIKeyFMVIWQNTLCSARQ-UHFFFAOYSA-N
MW240.31 g/mol
LogP-1.77
Rot. Bonds4

About 5-oxo-1-(2-piperazin-1-ylethyl)pyrrolidine-3-carboxamide

5-oxo-1-(2-piperazin-1-ylethyl)pyrrolidine-3-carboxamide (PubChem CID 168697234) has the molecular formula C11H20N4O2 and a molecular weight of 240.31 g/mol. Its IUPAC name is 5-oxo-1-(2-piperazin-1-ylethyl)pyrrolidine-3-carboxamide.

Molecular Properties

Compound Name5-oxo-1-(2-piperazin-1-ylethyl)pyrrolidine-3-carboxamide
PubChem CID168697234
Molecular FormulaC11H20N4O2
Molecular Weight240.31 g/mol
Exact Mass240.16
IUPAC Name5-oxo-1-(2-piperazin-1-ylethyl)pyrrolidine-3-carboxamide
SMILESNC(=O)C1CC(=O)N(CCN2CCNCC2)C1
InChIInChI=1S/C11H20N4O2/c12-11(17)9-7-10(16)15(8-9)6-5-14-3-1-13-2-4-14/h9,13H,1-8H2,(H2,12,17)
InChIKeyFMVIWQNTLCSARQ-UHFFFAOYSA-N
XLogP-1.77
TPSA78.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.31
LogP ≤ 5-1.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-[2-(4-methylpiperazin-1-yl)ethyl]-5-oxopyrrolidine-3-carboxamide
CID 168696347
5-oxo-1-(2-sulfanylethyl)pyrrolidine-3-carboxamide
CID 168697255
(3R)-5-oxo-1-(2-piperidin-1-ylethyl)pyrrolidine-3-carboxylic acid
CID 29136485
1-(2-methoxyethyl)-5-oxopyrrolidine-3-carboxamide
CID 17389931
(3S)-1-ethyl-5-oxopyrrolidine-3-carboxamide
CID 40586169
(3R)-1-ethyl-5-oxopyrrolidine-3-carboxamide
CID 40586168
7-(4-carbamoyl-2-oxopyrrolidin-1-yl)heptanoic acid
CID 168697198
(2S)-4-(4-carbamoyl-2-oxopyrrolidin-1-yl)-2-hydroxybutanoic acid
CID 168695887
1-(2-methoxyethyl)-5-oxo-N-(2-piperazin-1-ylethyl)pyrrolidine-3-carboxamide
CID 119444938
1-[2-[2-(2-hydroxyethoxy)ethoxy]ethyl]-5-oxopyrrolidine-3-carboxamide
CID 168697250
1-butyl-4-(piperazine-1-carbonyl)pyrrolidin-2-one
CID 82042052
1-[3-(3-aminopropylamino)propyl]-5-oxopyrrolidine-3-carboxamide
CID 168697217

Frequently Asked Questions

What is the IUPAC name of 5-oxo-1-(2-piperazin-1-ylethyl)pyrrolidine-3-carboxamide?
The IUPAC name of 5-oxo-1-(2-piperazin-1-ylethyl)pyrrolidine-3-carboxamide (CID 168697234) is 5-oxo-1-(2-piperazin-1-ylethyl)pyrrolidine-3-carboxamide.
What is the SMILES notation for 5-oxo-1-(2-piperazin-1-ylethyl)pyrrolidine-3-carboxamide?
The canonical SMILES for 5-oxo-1-(2-piperazin-1-ylethyl)pyrrolidine-3-carboxamide is NC(=O)C1CC(=O)N(CCN2CCNCC2)C1.
What is the InChIKey of 5-oxo-1-(2-piperazin-1-ylethyl)pyrrolidine-3-carboxamide?
The InChIKey is FMVIWQNTLCSARQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O2/c12-11(17)9-7-10(16)15(8-9)6-5-14-3-1-13-2-4-14/h9,13H,1-8H2,(H2,12,17).
What are the key properties of 5-oxo-1-(2-piperazin-1-ylethyl)pyrrolidine-3-carboxamide?
5-oxo-1-(2-piperazin-1-ylethyl)pyrrolidine-3-carboxamide has a molecular weight of 240.31 g/mol, XLogP of -1.77, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-oxo-1-(2-piperazin-1-ylethyl)pyrrolidine-3-carboxamide is sourced from PubChem (CID 168697234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).