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

C11H19N5 — CID 80831870

IUPAC6-[3-(dimethylamino)pyrrolidin-1-yl]-N-methylpyrazin-2-amine
SMILESCNc1cncc(N2CCC(N(C)C)C2)n1
InChIInChI=1S/C11H19N5/c1-12-10-6-13-7-11(14-10)16-5-4-9(8-16)15(2)3/h6-7,9H,4-5,8H2,1-3H3,(H,12,14)
InChIKeyMJBRPXSBECUAHW-UHFFFAOYSA-N
MW221.31 g/mol
LogP0.66
Rot. Bonds3

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

6-[3-(dimethylamino)pyrrolidin-1-yl]-N-methylpyrazin-2-amine (PubChem CID 80831870) has the molecular formula C11H19N5 and a molecular weight of 221.31 g/mol. Its IUPAC name is 6-[3-(dimethylamino)pyrrolidin-1-yl]-N-methylpyrazin-2-amine.

Molecular Properties

Compound Name6-[3-(dimethylamino)pyrrolidin-1-yl]-N-methylpyrazin-2-amine
PubChem CID80831870
Molecular FormulaC11H19N5
Molecular Weight221.31 g/mol
Exact Mass221.16
IUPAC Name6-[3-(dimethylamino)pyrrolidin-1-yl]-N-methylpyrazin-2-amine
SMILESCNc1cncc(N2CCC(N(C)C)C2)n1
InChIInChI=1S/C11H19N5/c1-12-10-6-13-7-11(14-10)16-5-4-9(8-16)15(2)3/h6-7,9H,4-5,8H2,1-3H3,(H,12,14)
InChIKeyMJBRPXSBECUAHW-UHFFFAOYSA-N
XLogP0.66
TPSA44.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.31
LogP ≤ 50.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-[3-(dimethylamino)pyrrolidin-1-yl]-N-methylpyrazin-2-amine?
The IUPAC name of 6-[3-(dimethylamino)pyrrolidin-1-yl]-N-methylpyrazin-2-amine (CID 80831870) is 6-[3-(dimethylamino)pyrrolidin-1-yl]-N-methylpyrazin-2-amine.
What is the SMILES notation for 6-[3-(dimethylamino)pyrrolidin-1-yl]-N-methylpyrazin-2-amine?
The canonical SMILES for 6-[3-(dimethylamino)pyrrolidin-1-yl]-N-methylpyrazin-2-amine is CNc1cncc(N2CCC(N(C)C)C2)n1.
What is the InChIKey of 6-[3-(dimethylamino)pyrrolidin-1-yl]-N-methylpyrazin-2-amine?
The InChIKey is MJBRPXSBECUAHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N5/c1-12-10-6-13-7-11(14-10)16-5-4-9(8-16)15(2)3/h6-7,9H,4-5,8H2,1-3H3,(H,12,14).
What are the key properties of 6-[3-(dimethylamino)pyrrolidin-1-yl]-N-methylpyrazin-2-amine?
6-[3-(dimethylamino)pyrrolidin-1-yl]-N-methylpyrazin-2-amine has a molecular weight of 221.31 g/mol, XLogP of 0.66, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[3-(dimethylamino)pyrrolidin-1-yl]-N-methylpyrazin-2-amine is sourced from PubChem (CID 80831870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).