2-(1-methylpyrazol-4-yl)-4-piperidin-3-ylpyrazolo[1,5-a]pyrazine

C15H18N6 — CID 172552276

IUPAC2-(1-methylpyrazol-4-yl)-4-piperidin-3-ylpyrazolo[1,5-a]pyrazine
SMILESCn1cc(-c2cc3c(C4CCCNC4)nccn3n2)cn1
InChIInChI=1S/C15H18N6/c1-20-10-12(9-18-20)13-7-14-15(11-3-2-4-16-8-11)17-5-6-21(14)19-13/h5-7,9-11,16H,2-4,8H2,1H3
InChIKeyNMCJHQUUFBADOU-UHFFFAOYSA-N
MW282.35 g/mol
LogP1.60
Rot. Bonds2

About 2-(1-methylpyrazol-4-yl)-4-piperidin-3-ylpyrazolo[1,5-a]pyrazine

2-(1-methylpyrazol-4-yl)-4-piperidin-3-ylpyrazolo[1,5-a]pyrazine (PubChem CID 172552276) has the molecular formula C15H18N6 and a molecular weight of 282.35 g/mol. Its IUPAC name is 2-(1-methylpyrazol-4-yl)-4-piperidin-3-ylpyrazolo[1,5-a]pyrazine.

Molecular Properties

Compound Name2-(1-methylpyrazol-4-yl)-4-piperidin-3-ylpyrazolo[1,5-a]pyrazine
PubChem CID172552276
Molecular FormulaC15H18N6
Molecular Weight282.35 g/mol
Exact Mass282.16
IUPAC Name2-(1-methylpyrazol-4-yl)-4-piperidin-3-ylpyrazolo[1,5-a]pyrazine
SMILESCn1cc(-c2cc3c(C4CCCNC4)nccn3n2)cn1
InChIInChI=1S/C15H18N6/c1-20-10-12(9-18-20)13-7-14-15(11-3-2-4-16-8-11)17-5-6-21(14)19-13/h5-7,9-11,16H,2-4,8H2,1H3
InChIKeyNMCJHQUUFBADOU-UHFFFAOYSA-N
XLogP1.60
TPSA60.04 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.35
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(1-methylpyrazol-4-yl)-4-piperidin-3-ylpyrazolo[1,5-a]pyrazine?
The IUPAC name of 2-(1-methylpyrazol-4-yl)-4-piperidin-3-ylpyrazolo[1,5-a]pyrazine (CID 172552276) is 2-(1-methylpyrazol-4-yl)-4-piperidin-3-ylpyrazolo[1,5-a]pyrazine.
What is the SMILES notation for 2-(1-methylpyrazol-4-yl)-4-piperidin-3-ylpyrazolo[1,5-a]pyrazine?
The canonical SMILES for 2-(1-methylpyrazol-4-yl)-4-piperidin-3-ylpyrazolo[1,5-a]pyrazine is Cn1cc(-c2cc3c(C4CCCNC4)nccn3n2)cn1.
What is the InChIKey of 2-(1-methylpyrazol-4-yl)-4-piperidin-3-ylpyrazolo[1,5-a]pyrazine?
The InChIKey is NMCJHQUUFBADOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N6/c1-20-10-12(9-18-20)13-7-14-15(11-3-2-4-16-8-11)17-5-6-21(14)19-13/h5-7,9-11,16H,2-4,8H2,1H3.
What are the key properties of 2-(1-methylpyrazol-4-yl)-4-piperidin-3-ylpyrazolo[1,5-a]pyrazine?
2-(1-methylpyrazol-4-yl)-4-piperidin-3-ylpyrazolo[1,5-a]pyrazine has a molecular weight of 282.35 g/mol, XLogP of 1.60, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methylpyrazol-4-yl)-4-piperidin-3-ylpyrazolo[1,5-a]pyrazine is sourced from PubChem (CID 172552276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).