N-methyl-1-[2-(2-oxo-1-pyridinyl)ethyl]piperazine-2-carboxamide

C13H20N4O2 — CID 82907635

IUPACN-methyl-1-[2-(2-oxo-1-pyridinyl)ethyl]piperazine-2-carboxamide
SMILESCNC(=O)C1CNCCN1CCn1ccccc1=O
InChIInChI=1S/C13H20N4O2/c1-14-13(19)11-10-15-5-7-16(11)8-9-17-6-3-2-4-12(17)18/h2-4,6,11,15H,5,7-10H2,1H3,(H,14,19)
InChIKeyUIMMWMCRJXWPSF-UHFFFAOYSA-N
MW264.33 g/mol
LogP-1.13
Rot. Bonds4

About N-methyl-1-[2-(2-oxo-1-pyridinyl)ethyl]piperazine-2-carboxamide

N-methyl-1-[2-(2-oxo-1-pyridinyl)ethyl]piperazine-2-carboxamide (PubChem CID 82907635) has the molecular formula C13H20N4O2 and a molecular weight of 264.33 g/mol. Its IUPAC name is N-methyl-1-[2-(2-oxo-1-pyridinyl)ethyl]piperazine-2-carboxamide.

Molecular Properties

Compound NameN-methyl-1-[2-(2-oxo-1-pyridinyl)ethyl]piperazine-2-carboxamide
PubChem CID82907635
Molecular FormulaC13H20N4O2
Molecular Weight264.33 g/mol
Exact Mass264.16
IUPAC NameN-methyl-1-[2-(2-oxo-1-pyridinyl)ethyl]piperazine-2-carboxamide
SMILESCNC(=O)C1CNCCN1CCn1ccccc1=O
InChIInChI=1S/C13H20N4O2/c1-14-13(19)11-10-15-5-7-16(11)8-9-17-6-3-2-4-12(17)18/h2-4,6,11,15H,5,7-10H2,1H3,(H,14,19)
InChIKeyUIMMWMCRJXWPSF-UHFFFAOYSA-N
XLogP-1.13
TPSA66.37 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 5-1.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[2-(2-oxo-1-pyridinyl)ethyl]piperazine-2-carboxamide?
The IUPAC name of N-methyl-1-[2-(2-oxo-1-pyridinyl)ethyl]piperazine-2-carboxamide (CID 82907635) is N-methyl-1-[2-(2-oxo-1-pyridinyl)ethyl]piperazine-2-carboxamide.
What is the SMILES notation for N-methyl-1-[2-(2-oxo-1-pyridinyl)ethyl]piperazine-2-carboxamide?
The canonical SMILES for N-methyl-1-[2-(2-oxo-1-pyridinyl)ethyl]piperazine-2-carboxamide is CNC(=O)C1CNCCN1CCn1ccccc1=O.
What is the InChIKey of N-methyl-1-[2-(2-oxo-1-pyridinyl)ethyl]piperazine-2-carboxamide?
The InChIKey is UIMMWMCRJXWPSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O2/c1-14-13(19)11-10-15-5-7-16(11)8-9-17-6-3-2-4-12(17)18/h2-4,6,11,15H,5,7-10H2,1H3,(H,14,19).
What are the key properties of N-methyl-1-[2-(2-oxo-1-pyridinyl)ethyl]piperazine-2-carboxamide?
N-methyl-1-[2-(2-oxo-1-pyridinyl)ethyl]piperazine-2-carboxamide has a molecular weight of 264.33 g/mol, XLogP of -1.13, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[2-(2-oxo-1-pyridinyl)ethyl]piperazine-2-carboxamide is sourced from PubChem (CID 82907635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).