(2S)-2-methyl-N-pyrazin-2-ylpyrrolidine-2-carboxamide

C10H14N4O — CID 59436345

IUPAC(2S)-2-methyl-N-pyrazin-2-ylpyrrolidine-2-carboxamide
SMILESC[C@@]1(C(=O)Nc2cnccn2)CCCN1
InChIInChI=1S/C10H14N4O/c1-10(3-2-4-13-10)9(15)14-8-7-11-5-6-12-8/h5-7,13H,2-4H2,1H3,(H,12,14,15)/t10-/m0/s1
InChIKeyLMZVQUMFPJLOML-JTQLQIEISA-N
MW206.25 g/mol
LogP0.56
Rot. Bonds2

About (2S)-2-methyl-N-pyrazin-2-ylpyrrolidine-2-carboxamide

(2S)-2-methyl-N-pyrazin-2-ylpyrrolidine-2-carboxamide (PubChem CID 59436345) has the molecular formula C10H14N4O and a molecular weight of 206.25 g/mol. Its IUPAC name is (2S)-2-methyl-N-pyrazin-2-ylpyrrolidine-2-carboxamide.

Molecular Properties

Compound Name(2S)-2-methyl-N-pyrazin-2-ylpyrrolidine-2-carboxamide
PubChem CID59436345
Molecular FormulaC10H14N4O
Molecular Weight206.25 g/mol
Exact Mass206.12
IUPAC Name(2S)-2-methyl-N-pyrazin-2-ylpyrrolidine-2-carboxamide
SMILESC[C@@]1(C(=O)Nc2cnccn2)CCCN1
InChIInChI=1S/C10H14N4O/c1-10(3-2-4-13-10)9(15)14-8-7-11-5-6-12-8/h5-7,13H,2-4H2,1H3,(H,12,14,15)/t10-/m0/s1
InChIKeyLMZVQUMFPJLOML-JTQLQIEISA-N
XLogP0.56
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.25
LogP ≤ 50.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2S)-2-methyl-N-pyrazin-2-ylpyrrolidine-2-carboxamide?
The IUPAC name of (2S)-2-methyl-N-pyrazin-2-ylpyrrolidine-2-carboxamide (CID 59436345) is (2S)-2-methyl-N-pyrazin-2-ylpyrrolidine-2-carboxamide.
What is the SMILES notation for (2S)-2-methyl-N-pyrazin-2-ylpyrrolidine-2-carboxamide?
The canonical SMILES for (2S)-2-methyl-N-pyrazin-2-ylpyrrolidine-2-carboxamide is C[C@@]1(C(=O)Nc2cnccn2)CCCN1.
What is the InChIKey of (2S)-2-methyl-N-pyrazin-2-ylpyrrolidine-2-carboxamide?
The InChIKey is LMZVQUMFPJLOML-JTQLQIEISA-N. The full InChI is InChI=1S/C10H14N4O/c1-10(3-2-4-13-10)9(15)14-8-7-11-5-6-12-8/h5-7,13H,2-4H2,1H3,(H,12,14,15)/t10-/m0/s1.
What are the key properties of (2S)-2-methyl-N-pyrazin-2-ylpyrrolidine-2-carboxamide?
(2S)-2-methyl-N-pyrazin-2-ylpyrrolidine-2-carboxamide has a molecular weight of 206.25 g/mol, XLogP of 0.56, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-methyl-N-pyrazin-2-ylpyrrolidine-2-carboxamide is sourced from PubChem (CID 59436345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).