2-methyl-6-(pyrrolidin-3-ylmethyl)-1,2-dihydropyrazine

C10H17N3 — CID 135135085

IUPAC2-methyl-6-(pyrrolidin-3-ylmethyl)-1,2-dihydropyrazine
SMILESCC1C=NC=C(CC2CCNC2)N1
InChIInChI=1S/C10H17N3/c1-8-5-12-7-10(13-8)4-9-2-3-11-6-9/h5,7-9,11,13H,2-4,6H2,1H3
InChIKeyBEFHGTYNUQJJDJ-UHFFFAOYSA-N
MW179.27 g/mol
LogP0.89
Rot. Bonds2

About 2-methyl-6-(pyrrolidin-3-ylmethyl)-1,2-dihydropyrazine

2-methyl-6-(pyrrolidin-3-ylmethyl)-1,2-dihydropyrazine (PubChem CID 135135085) has the molecular formula C10H17N3 and a molecular weight of 179.27 g/mol. Its IUPAC name is 2-methyl-6-(pyrrolidin-3-ylmethyl)-1,2-dihydropyrazine.

Molecular Properties

Compound Name2-methyl-6-(pyrrolidin-3-ylmethyl)-1,2-dihydropyrazine
PubChem CID135135085
Molecular FormulaC10H17N3
Molecular Weight179.27 g/mol
Exact Mass179.14
IUPAC Name2-methyl-6-(pyrrolidin-3-ylmethyl)-1,2-dihydropyrazine
SMILESCC1C=NC=C(CC2CCNC2)N1
InChIInChI=1S/C10H17N3/c1-8-5-12-7-10(13-8)4-9-2-3-11-6-9/h5,7-9,11,13H,2-4,6H2,1H3
InChIKeyBEFHGTYNUQJJDJ-UHFFFAOYSA-N
XLogP0.89
TPSA36.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.27
LogP ≤ 50.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-(pyrrolidin-3-ylmethyl)-1,2-dihydropyrazine?
The IUPAC name of 2-methyl-6-(pyrrolidin-3-ylmethyl)-1,2-dihydropyrazine (CID 135135085) is 2-methyl-6-(pyrrolidin-3-ylmethyl)-1,2-dihydropyrazine.
What is the SMILES notation for 2-methyl-6-(pyrrolidin-3-ylmethyl)-1,2-dihydropyrazine?
The canonical SMILES for 2-methyl-6-(pyrrolidin-3-ylmethyl)-1,2-dihydropyrazine is CC1C=NC=C(CC2CCNC2)N1.
What is the InChIKey of 2-methyl-6-(pyrrolidin-3-ylmethyl)-1,2-dihydropyrazine?
The InChIKey is BEFHGTYNUQJJDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3/c1-8-5-12-7-10(13-8)4-9-2-3-11-6-9/h5,7-9,11,13H,2-4,6H2,1H3.
What are the key properties of 2-methyl-6-(pyrrolidin-3-ylmethyl)-1,2-dihydropyrazine?
2-methyl-6-(pyrrolidin-3-ylmethyl)-1,2-dihydropyrazine has a molecular weight of 179.27 g/mol, XLogP of 0.89, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-(pyrrolidin-3-ylmethyl)-1,2-dihydropyrazine is sourced from PubChem (CID 135135085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).