N-ethyl-N-methyl-1-pyrazin-2-ylpiperidine-4-carboxamide

C13H20N4O — CID 134005797

IUPACN-ethyl-N-methyl-1-pyrazin-2-ylpiperidine-4-carboxamide
SMILESCCN(C)C(=O)C1CCN(c2cnccn2)CC1
InChIInChI=1S/C13H20N4O/c1-3-16(2)13(18)11-4-8-17(9-5-11)12-10-14-6-7-15-12/h6-7,10-11H,3-5,8-9H2,1-2H3
InChIKeySGIPZFRFDBQZAF-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.17
Rot. Bonds3

About N-ethyl-N-methyl-1-pyrazin-2-ylpiperidine-4-carboxamide

N-ethyl-N-methyl-1-pyrazin-2-ylpiperidine-4-carboxamide (PubChem CID 134005797) has the molecular formula C13H20N4O and a molecular weight of 248.33 g/mol. Its IUPAC name is N-ethyl-N-methyl-1-pyrazin-2-ylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-ethyl-N-methyl-1-pyrazin-2-ylpiperidine-4-carboxamide
PubChem CID134005797
Molecular FormulaC13H20N4O
Molecular Weight248.33 g/mol
Exact Mass248.16
IUPAC NameN-ethyl-N-methyl-1-pyrazin-2-ylpiperidine-4-carboxamide
SMILESCCN(C)C(=O)C1CCN(c2cnccn2)CC1
InChIInChI=1S/C13H20N4O/c1-3-16(2)13(18)11-4-8-17(9-5-11)12-10-14-6-7-15-12/h6-7,10-11H,3-5,8-9H2,1-2H3
InChIKeySGIPZFRFDBQZAF-UHFFFAOYSA-N
XLogP1.17
TPSA49.33 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-methyl-1-pyrazin-2-ylpiperidine-4-carboxamide?
The IUPAC name of N-ethyl-N-methyl-1-pyrazin-2-ylpiperidine-4-carboxamide (CID 134005797) is N-ethyl-N-methyl-1-pyrazin-2-ylpiperidine-4-carboxamide.
What is the SMILES notation for N-ethyl-N-methyl-1-pyrazin-2-ylpiperidine-4-carboxamide?
The canonical SMILES for N-ethyl-N-methyl-1-pyrazin-2-ylpiperidine-4-carboxamide is CCN(C)C(=O)C1CCN(c2cnccn2)CC1.
What is the InChIKey of N-ethyl-N-methyl-1-pyrazin-2-ylpiperidine-4-carboxamide?
The InChIKey is SGIPZFRFDBQZAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O/c1-3-16(2)13(18)11-4-8-17(9-5-11)12-10-14-6-7-15-12/h6-7,10-11H,3-5,8-9H2,1-2H3.
What are the key properties of N-ethyl-N-methyl-1-pyrazin-2-ylpiperidine-4-carboxamide?
N-ethyl-N-methyl-1-pyrazin-2-ylpiperidine-4-carboxamide has a molecular weight of 248.33 g/mol, XLogP of 1.17, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-methyl-1-pyrazin-2-ylpiperidine-4-carboxamide is sourced from PubChem (CID 134005797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).