6-[3-(dimethylamino)-4-methylpyrrolidin-1-yl]-N-methylpyrazin-2-amine

C12H21N5 — CID 81469556

IUPAC6-[3-(dimethylamino)-4-methylpyrrolidin-1-yl]-N-methylpyrazin-2-amine
SMILESCNc1cncc(N2CC(C)C(N(C)C)C2)n1
InChIInChI=1S/C12H21N5/c1-9-7-17(8-10(9)16(3)4)12-6-14-5-11(13-2)15-12/h5-6,9-10H,7-8H2,1-4H3,(H,13,15)
InChIKeyRCLDGPXUQGJDQD-UHFFFAOYSA-N
MW235.33 g/mol
LogP0.90
Rot. Bonds3

About 6-[3-(dimethylamino)-4-methylpyrrolidin-1-yl]-N-methylpyrazin-2-amine

6-[3-(dimethylamino)-4-methylpyrrolidin-1-yl]-N-methylpyrazin-2-amine (PubChem CID 81469556) has the molecular formula C12H21N5 and a molecular weight of 235.33 g/mol. Its IUPAC name is 6-[3-(dimethylamino)-4-methylpyrrolidin-1-yl]-N-methylpyrazin-2-amine.

Molecular Properties

Compound Name6-[3-(dimethylamino)-4-methylpyrrolidin-1-yl]-N-methylpyrazin-2-amine
PubChem CID81469556
Molecular FormulaC12H21N5
Molecular Weight235.33 g/mol
Exact Mass235.18
IUPAC Name6-[3-(dimethylamino)-4-methylpyrrolidin-1-yl]-N-methylpyrazin-2-amine
SMILESCNc1cncc(N2CC(C)C(N(C)C)C2)n1
InChIInChI=1S/C12H21N5/c1-9-7-17(8-10(9)16(3)4)12-6-14-5-11(13-2)15-12/h5-6,9-10H,7-8H2,1-4H3,(H,13,15)
InChIKeyRCLDGPXUQGJDQD-UHFFFAOYSA-N
XLogP0.90
TPSA44.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 50.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-[3-(dimethylamino)-4-methylpyrrolidin-1-yl]-N-methylpyrazin-2-amine?
The IUPAC name of 6-[3-(dimethylamino)-4-methylpyrrolidin-1-yl]-N-methylpyrazin-2-amine (CID 81469556) is 6-[3-(dimethylamino)-4-methylpyrrolidin-1-yl]-N-methylpyrazin-2-amine.
What is the SMILES notation for 6-[3-(dimethylamino)-4-methylpyrrolidin-1-yl]-N-methylpyrazin-2-amine?
The canonical SMILES for 6-[3-(dimethylamino)-4-methylpyrrolidin-1-yl]-N-methylpyrazin-2-amine is CNc1cncc(N2CC(C)C(N(C)C)C2)n1.
What is the InChIKey of 6-[3-(dimethylamino)-4-methylpyrrolidin-1-yl]-N-methylpyrazin-2-amine?
The InChIKey is RCLDGPXUQGJDQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N5/c1-9-7-17(8-10(9)16(3)4)12-6-14-5-11(13-2)15-12/h5-6,9-10H,7-8H2,1-4H3,(H,13,15).
What are the key properties of 6-[3-(dimethylamino)-4-methylpyrrolidin-1-yl]-N-methylpyrazin-2-amine?
6-[3-(dimethylamino)-4-methylpyrrolidin-1-yl]-N-methylpyrazin-2-amine has a molecular weight of 235.33 g/mol, XLogP of 0.90, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[3-(dimethylamino)-4-methylpyrrolidin-1-yl]-N-methylpyrazin-2-amine is sourced from PubChem (CID 81469556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).