1-(3-pyrazol-1-ylpyrazin-2-yl)pyrrolidin-3-amine

C11H14N6 — CID 102549408

IUPAC1-(3-pyrazol-1-ylpyrazin-2-yl)pyrrolidin-3-amine
SMILESNC1CCN(c2nccnc2-n2cccn2)C1
InChIInChI=1S/C11H14N6/c12-9-2-7-16(8-9)10-11(14-5-4-13-10)17-6-1-3-15-17/h1,3-6,9H,2,7-8,12H2
InChIKeyGQQHEYODYOJLGG-UHFFFAOYSA-N
MW230.28 g/mol
LogP0.20
Rot. Bonds2

About 1-(3-pyrazol-1-ylpyrazin-2-yl)pyrrolidin-3-amine

1-(3-pyrazol-1-ylpyrazin-2-yl)pyrrolidin-3-amine (PubChem CID 102549408) has the molecular formula C11H14N6 and a molecular weight of 230.28 g/mol. Its IUPAC name is 1-(3-pyrazol-1-ylpyrazin-2-yl)pyrrolidin-3-amine.

Molecular Properties

Compound Name1-(3-pyrazol-1-ylpyrazin-2-yl)pyrrolidin-3-amine
PubChem CID102549408
Molecular FormulaC11H14N6
Molecular Weight230.28 g/mol
Exact Mass230.13
IUPAC Name1-(3-pyrazol-1-ylpyrazin-2-yl)pyrrolidin-3-amine
SMILESNC1CCN(c2nccnc2-n2cccn2)C1
InChIInChI=1S/C11H14N6/c12-9-2-7-16(8-9)10-11(14-5-4-13-10)17-6-1-3-15-17/h1,3-6,9H,2,7-8,12H2
InChIKeyGQQHEYODYOJLGG-UHFFFAOYSA-N
XLogP0.20
TPSA72.86 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.28
LogP ≤ 50.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-(3-pyrazol-1-ylpyrazin-2-yl)pyrrolidin-3-amine?
The IUPAC name of 1-(3-pyrazol-1-ylpyrazin-2-yl)pyrrolidin-3-amine (CID 102549408) is 1-(3-pyrazol-1-ylpyrazin-2-yl)pyrrolidin-3-amine.
What is the SMILES notation for 1-(3-pyrazol-1-ylpyrazin-2-yl)pyrrolidin-3-amine?
The canonical SMILES for 1-(3-pyrazol-1-ylpyrazin-2-yl)pyrrolidin-3-amine is NC1CCN(c2nccnc2-n2cccn2)C1.
What is the InChIKey of 1-(3-pyrazol-1-ylpyrazin-2-yl)pyrrolidin-3-amine?
The InChIKey is GQQHEYODYOJLGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N6/c12-9-2-7-16(8-9)10-11(14-5-4-13-10)17-6-1-3-15-17/h1,3-6,9H,2,7-8,12H2.
What are the key properties of 1-(3-pyrazol-1-ylpyrazin-2-yl)pyrrolidin-3-amine?
1-(3-pyrazol-1-ylpyrazin-2-yl)pyrrolidin-3-amine has a molecular weight of 230.28 g/mol, XLogP of 0.20, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-pyrazol-1-ylpyrazin-2-yl)pyrrolidin-3-amine is sourced from PubChem (CID 102549408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).