1-(5-cyanopyrazin-2-yl)-N,N-dimethylpyrrolidine-2-carboxamide

C12H15N5O — CID 133290399

IUPAC1-(5-cyanopyrazin-2-yl)-N,N-dimethylpyrrolidine-2-carboxamide
SMILESCN(C)C(=O)C1CCCN1c1cnc(C#N)cn1
InChIInChI=1S/C12H15N5O/c1-16(2)12(18)10-4-3-5-17(10)11-8-14-9(6-13)7-15-11/h7-8,10H,3-5H2,1-2H3
InChIKeyRIZGZTSEFQANLI-UHFFFAOYSA-N
MW245.29 g/mol
LogP0.41
Rot. Bonds2

About 1-(5-cyanopyrazin-2-yl)-N,N-dimethylpyrrolidine-2-carboxamide

1-(5-cyanopyrazin-2-yl)-N,N-dimethylpyrrolidine-2-carboxamide (PubChem CID 133290399) has the molecular formula C12H15N5O and a molecular weight of 245.29 g/mol. Its IUPAC name is 1-(5-cyanopyrazin-2-yl)-N,N-dimethylpyrrolidine-2-carboxamide.

Molecular Properties

Compound Name1-(5-cyanopyrazin-2-yl)-N,N-dimethylpyrrolidine-2-carboxamide
PubChem CID133290399
Molecular FormulaC12H15N5O
Molecular Weight245.29 g/mol
Exact Mass245.13
IUPAC Name1-(5-cyanopyrazin-2-yl)-N,N-dimethylpyrrolidine-2-carboxamide
SMILESCN(C)C(=O)C1CCCN1c1cnc(C#N)cn1
InChIInChI=1S/C12H15N5O/c1-16(2)12(18)10-4-3-5-17(10)11-8-14-9(6-13)7-15-11/h7-8,10H,3-5H2,1-2H3
InChIKeyRIZGZTSEFQANLI-UHFFFAOYSA-N
XLogP0.41
TPSA73.12 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.29
LogP ≤ 50.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(5-cyanopyrazin-2-yl)-N,N-dimethylpyrrolidine-2-carboxamide?
The IUPAC name of 1-(5-cyanopyrazin-2-yl)-N,N-dimethylpyrrolidine-2-carboxamide (CID 133290399) is 1-(5-cyanopyrazin-2-yl)-N,N-dimethylpyrrolidine-2-carboxamide.
What is the SMILES notation for 1-(5-cyanopyrazin-2-yl)-N,N-dimethylpyrrolidine-2-carboxamide?
The canonical SMILES for 1-(5-cyanopyrazin-2-yl)-N,N-dimethylpyrrolidine-2-carboxamide is CN(C)C(=O)C1CCCN1c1cnc(C#N)cn1.
What is the InChIKey of 1-(5-cyanopyrazin-2-yl)-N,N-dimethylpyrrolidine-2-carboxamide?
The InChIKey is RIZGZTSEFQANLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N5O/c1-16(2)12(18)10-4-3-5-17(10)11-8-14-9(6-13)7-15-11/h7-8,10H,3-5H2,1-2H3.
What are the key properties of 1-(5-cyanopyrazin-2-yl)-N,N-dimethylpyrrolidine-2-carboxamide?
1-(5-cyanopyrazin-2-yl)-N,N-dimethylpyrrolidine-2-carboxamide has a molecular weight of 245.29 g/mol, XLogP of 0.41, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-cyanopyrazin-2-yl)-N,N-dimethylpyrrolidine-2-carboxamide is sourced from PubChem (CID 133290399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).