3,6-dimethyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]pyrazin-2-amine

C12H20N4 — CID 104973149

IUPAC3,6-dimethyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]pyrazin-2-amine
SMILESCc1cnc(C)c(NCC[C@H]2CCCN2)n1
InChIInChI=1S/C12H20N4/c1-9-8-15-10(2)12(16-9)14-7-5-11-4-3-6-13-11/h8,11,13H,3-7H2,1-2H3,(H,14,16)/t11-/m1/s1
InChIKeyYNELKTFFLLRZFP-LLVKDONJSA-N
MW220.32 g/mol
LogP1.65
Rot. Bonds4

About 3,6-dimethyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]pyrazin-2-amine

3,6-dimethyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]pyrazin-2-amine (PubChem CID 104973149) has the molecular formula C12H20N4 and a molecular weight of 220.32 g/mol. Its IUPAC name is 3,6-dimethyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]pyrazin-2-amine.

Molecular Properties

Compound Name3,6-dimethyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]pyrazin-2-amine
PubChem CID104973149
Molecular FormulaC12H20N4
Molecular Weight220.32 g/mol
Exact Mass220.17
IUPAC Name3,6-dimethyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]pyrazin-2-amine
SMILESCc1cnc(C)c(NCC[C@H]2CCCN2)n1
InChIInChI=1S/C12H20N4/c1-9-8-15-10(2)12(16-9)14-7-5-11-4-3-6-13-11/h8,11,13H,3-7H2,1-2H3,(H,14,16)/t11-/m1/s1
InChIKeyYNELKTFFLLRZFP-LLVKDONJSA-N
XLogP1.65
TPSA49.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3,6-dimethyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]pyrazin-2-amine?
The IUPAC name of 3,6-dimethyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]pyrazin-2-amine (CID 104973149) is 3,6-dimethyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]pyrazin-2-amine.
What is the SMILES notation for 3,6-dimethyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]pyrazin-2-amine?
The canonical SMILES for 3,6-dimethyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]pyrazin-2-amine is Cc1cnc(C)c(NCC[C@H]2CCCN2)n1.
What is the InChIKey of 3,6-dimethyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]pyrazin-2-amine?
The InChIKey is YNELKTFFLLRZFP-LLVKDONJSA-N. The full InChI is InChI=1S/C12H20N4/c1-9-8-15-10(2)12(16-9)14-7-5-11-4-3-6-13-11/h8,11,13H,3-7H2,1-2H3,(H,14,16)/t11-/m1/s1.
What are the key properties of 3,6-dimethyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]pyrazin-2-amine?
3,6-dimethyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]pyrazin-2-amine has a molecular weight of 220.32 g/mol, XLogP of 1.65, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6-dimethyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]pyrazin-2-amine is sourced from PubChem (CID 104973149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).