3-methyl-1-[6-(methylamino)pyrazin-2-yl]pyrrolidine-3-carboxamide

C11H17N5O — CID 114082567

IUPAC3-methyl-1-[6-(methylamino)pyrazin-2-yl]pyrrolidine-3-carboxamide
SMILESCNc1cncc(N2CCC(C)(C(N)=O)C2)n1
InChIInChI=1S/C11H17N5O/c1-11(10(12)17)3-4-16(7-11)9-6-14-5-8(13-2)15-9/h5-6H,3-4,7H2,1-2H3,(H2,12,17)(H,13,15)
InChIKeyUYVPLHMDFGVZDR-UHFFFAOYSA-N
MW235.29 g/mol
LogP0.22
Rot. Bonds3

About 3-methyl-1-[6-(methylamino)pyrazin-2-yl]pyrrolidine-3-carboxamide

3-methyl-1-[6-(methylamino)pyrazin-2-yl]pyrrolidine-3-carboxamide (PubChem CID 114082567) has the molecular formula C11H17N5O and a molecular weight of 235.29 g/mol. Its IUPAC name is 3-methyl-1-[6-(methylamino)pyrazin-2-yl]pyrrolidine-3-carboxamide.

Molecular Properties

Compound Name3-methyl-1-[6-(methylamino)pyrazin-2-yl]pyrrolidine-3-carboxamide
PubChem CID114082567
Molecular FormulaC11H17N5O
Molecular Weight235.29 g/mol
Exact Mass235.14
IUPAC Name3-methyl-1-[6-(methylamino)pyrazin-2-yl]pyrrolidine-3-carboxamide
SMILESCNc1cncc(N2CCC(C)(C(N)=O)C2)n1
InChIInChI=1S/C11H17N5O/c1-11(10(12)17)3-4-16(7-11)9-6-14-5-8(13-2)15-9/h5-6H,3-4,7H2,1-2H3,(H2,12,17)(H,13,15)
InChIKeyUYVPLHMDFGVZDR-UHFFFAOYSA-N
XLogP0.22
TPSA84.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.29
LogP ≤ 50.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-[4-[6-(methylamino)pyrazin-2-yl]piperazin-1-yl]ethanone
CID 80766880
N-methyl-6-(2,2,6,6-tetramethylmorpholin-4-yl)pyrazin-2-amine
CID 102746695
1-[6-[(3R)-3-(2-ethoxyphenoxy)piperidin-1-yl]pyrazin-2-yl]-3-methylpyrrolidine-3-carboxamide
CID 156541117
3-methyl-1-(6-methylsulfanylpyrazin-2-yl)pyrrolidine-3-carboxylic acid
CID 122052560
6-(3,3-dimethylpyrrolidin-1-yl)pyrazin-2-amine
CID 79034078
N,3-dimethyl-1-[6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]pyrrolidine-3-carboxamide
CID 106322336
6-(3-hydroxy-3-methylpyrrolidin-1-yl)pyrazine-2-carboxylic acid
CID 103356411
5-amino-6-(3-carbamoyl-3-methylpyrrolidin-1-yl)pyridine-2-carboxylic acid
CID 114082438
6-(3,3-dimethylpiperidin-1-yl)-N-propylpyrazin-2-amine
CID 80835299
(4,4-dimethylpiperidin-1-yl)-[6-(methylamino)pyrazin-2-yl]methanone
CID 114035906
1-(4-carbamothioyl-6-methyl-2-pyridinyl)-N,3-dimethylpyrrolidine-3-carboxamide
CID 106318515
N,3-dimethyl-1-[2-(methylamino)pyrimidin-4-yl]pyrrolidine-3-carboxamide
CID 106322389

Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-[6-(methylamino)pyrazin-2-yl]pyrrolidine-3-carboxamide?
The IUPAC name of 3-methyl-1-[6-(methylamino)pyrazin-2-yl]pyrrolidine-3-carboxamide (CID 114082567) is 3-methyl-1-[6-(methylamino)pyrazin-2-yl]pyrrolidine-3-carboxamide.
What is the SMILES notation for 3-methyl-1-[6-(methylamino)pyrazin-2-yl]pyrrolidine-3-carboxamide?
The canonical SMILES for 3-methyl-1-[6-(methylamino)pyrazin-2-yl]pyrrolidine-3-carboxamide is CNc1cncc(N2CCC(C)(C(N)=O)C2)n1.
What is the InChIKey of 3-methyl-1-[6-(methylamino)pyrazin-2-yl]pyrrolidine-3-carboxamide?
The InChIKey is UYVPLHMDFGVZDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N5O/c1-11(10(12)17)3-4-16(7-11)9-6-14-5-8(13-2)15-9/h5-6H,3-4,7H2,1-2H3,(H2,12,17)(H,13,15).
What are the key properties of 3-methyl-1-[6-(methylamino)pyrazin-2-yl]pyrrolidine-3-carboxamide?
3-methyl-1-[6-(methylamino)pyrazin-2-yl]pyrrolidine-3-carboxamide has a molecular weight of 235.29 g/mol, XLogP of 0.22, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-[6-(methylamino)pyrazin-2-yl]pyrrolidine-3-carboxamide is sourced from PubChem (CID 114082567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).