N-(1-piperidin-4-ylpyrazol-4-yl)pyrazin-2-amine

C12H16N6 — CID 142777161

IUPACN-(1-piperidin-4-ylpyrazol-4-yl)pyrazin-2-amine
SMILESc1cnc(Nc2cnn(C3CCNCC3)c2)cn1
InChIInChI=1S/C12H16N6/c1-3-13-4-2-11(1)18-9-10(7-16-18)17-12-8-14-5-6-15-12/h5-9,11,13H,1-4H2,(H,15,17)
InChIKeyBQPUVAKGNHVNDE-UHFFFAOYSA-N
MW244.30 g/mol
LogP1.34
Rot. Bonds3

About N-(1-piperidin-4-ylpyrazol-4-yl)pyrazin-2-amine

N-(1-piperidin-4-ylpyrazol-4-yl)pyrazin-2-amine (PubChem CID 142777161) has the molecular formula C12H16N6 and a molecular weight of 244.30 g/mol. Its IUPAC name is N-(1-piperidin-4-ylpyrazol-4-yl)pyrazin-2-amine.

Molecular Properties

Compound NameN-(1-piperidin-4-ylpyrazol-4-yl)pyrazin-2-amine
PubChem CID142777161
Molecular FormulaC12H16N6
Molecular Weight244.30 g/mol
Exact Mass244.14
IUPAC NameN-(1-piperidin-4-ylpyrazol-4-yl)pyrazin-2-amine
SMILESc1cnc(Nc2cnn(C3CCNCC3)c2)cn1
InChIInChI=1S/C12H16N6/c1-3-13-4-2-11(1)18-9-10(7-16-18)17-12-8-14-5-6-15-12/h5-9,11,13H,1-4H2,(H,15,17)
InChIKeyBQPUVAKGNHVNDE-UHFFFAOYSA-N
XLogP1.34
TPSA67.66 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.30
LogP ≤ 51.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(1-piperidin-4-ylpyrazol-4-yl)pyrazin-2-amine?
The IUPAC name of N-(1-piperidin-4-ylpyrazol-4-yl)pyrazin-2-amine (CID 142777161) is N-(1-piperidin-4-ylpyrazol-4-yl)pyrazin-2-amine.
What is the SMILES notation for N-(1-piperidin-4-ylpyrazol-4-yl)pyrazin-2-amine?
The canonical SMILES for N-(1-piperidin-4-ylpyrazol-4-yl)pyrazin-2-amine is c1cnc(Nc2cnn(C3CCNCC3)c2)cn1.
What is the InChIKey of N-(1-piperidin-4-ylpyrazol-4-yl)pyrazin-2-amine?
The InChIKey is BQPUVAKGNHVNDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N6/c1-3-13-4-2-11(1)18-9-10(7-16-18)17-12-8-14-5-6-15-12/h5-9,11,13H,1-4H2,(H,15,17).
What are the key properties of N-(1-piperidin-4-ylpyrazol-4-yl)pyrazin-2-amine?
N-(1-piperidin-4-ylpyrazol-4-yl)pyrazin-2-amine has a molecular weight of 244.30 g/mol, XLogP of 1.34, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-piperidin-4-ylpyrazol-4-yl)pyrazin-2-amine is sourced from PubChem (CID 142777161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).