(2R)-1-ethyl-N-methyl-2-pyrazin-2-ylpyrrolidine-2-carboxamide

C12H18N4O — CID 124991793

IUPAC(2R)-1-ethyl-N-methyl-2-pyrazin-2-ylpyrrolidine-2-carboxamide
SMILESCCN1CCC[C@]1(C(=O)NC)c1cnccn1
InChIInChI=1S/C12H18N4O/c1-3-16-8-4-5-12(16,11(17)13-2)10-9-14-6-7-15-10/h6-7,9H,3-5,8H2,1-2H3,(H,13,17)/t12-/m1/s1
InChIKeyPLSYGVZEXAFUGV-GFCCVEGCSA-N
MW234.30 g/mol
LogP0.53
Rot. Bonds3

About (2R)-1-ethyl-N-methyl-2-pyrazin-2-ylpyrrolidine-2-carboxamide

(2R)-1-ethyl-N-methyl-2-pyrazin-2-ylpyrrolidine-2-carboxamide (PubChem CID 124991793) has the molecular formula C12H18N4O and a molecular weight of 234.30 g/mol. Its IUPAC name is (2R)-1-ethyl-N-methyl-2-pyrazin-2-ylpyrrolidine-2-carboxamide.

Molecular Properties

Compound Name(2R)-1-ethyl-N-methyl-2-pyrazin-2-ylpyrrolidine-2-carboxamide
PubChem CID124991793
Molecular FormulaC12H18N4O
Molecular Weight234.30 g/mol
Exact Mass234.15
IUPAC Name(2R)-1-ethyl-N-methyl-2-pyrazin-2-ylpyrrolidine-2-carboxamide
SMILESCCN1CCC[C@]1(C(=O)NC)c1cnccn1
InChIInChI=1S/C12H18N4O/c1-3-16-8-4-5-12(16,11(17)13-2)10-9-14-6-7-15-10/h6-7,9H,3-5,8H2,1-2H3,(H,13,17)/t12-/m1/s1
InChIKeyPLSYGVZEXAFUGV-GFCCVEGCSA-N
XLogP0.53
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 50.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2R)-1-ethyl-N-methyl-2-pyrazin-2-ylpyrrolidine-2-carboxamide?
The IUPAC name of (2R)-1-ethyl-N-methyl-2-pyrazin-2-ylpyrrolidine-2-carboxamide (CID 124991793) is (2R)-1-ethyl-N-methyl-2-pyrazin-2-ylpyrrolidine-2-carboxamide.
What is the SMILES notation for (2R)-1-ethyl-N-methyl-2-pyrazin-2-ylpyrrolidine-2-carboxamide?
The canonical SMILES for (2R)-1-ethyl-N-methyl-2-pyrazin-2-ylpyrrolidine-2-carboxamide is CCN1CCC[C@]1(C(=O)NC)c1cnccn1.
What is the InChIKey of (2R)-1-ethyl-N-methyl-2-pyrazin-2-ylpyrrolidine-2-carboxamide?
The InChIKey is PLSYGVZEXAFUGV-GFCCVEGCSA-N. The full InChI is InChI=1S/C12H18N4O/c1-3-16-8-4-5-12(16,11(17)13-2)10-9-14-6-7-15-10/h6-7,9H,3-5,8H2,1-2H3,(H,13,17)/t12-/m1/s1.
What are the key properties of (2R)-1-ethyl-N-methyl-2-pyrazin-2-ylpyrrolidine-2-carboxamide?
(2R)-1-ethyl-N-methyl-2-pyrazin-2-ylpyrrolidine-2-carboxamide has a molecular weight of 234.30 g/mol, XLogP of 0.53, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-ethyl-N-methyl-2-pyrazin-2-ylpyrrolidine-2-carboxamide is sourced from PubChem (CID 124991793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).