3-ethyl-5-(2-methylpropyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine

C12H21N3 — CID 169194372

IUPAC3-ethyl-5-(2-methylpropyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine
SMILESCCc1cnn2c1CN(CC(C)C)CC2
InChIInChI=1S/C12H21N3/c1-4-11-7-13-15-6-5-14(8-10(2)3)9-12(11)15/h7,10H,4-6,8-9H2,1-3H3
InChIKeySKZSOWZUTUCIIX-UHFFFAOYSA-N
MW207.32 g/mol
LogP1.92
Rot. Bonds3

About 3-ethyl-5-(2-methylpropyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine

3-ethyl-5-(2-methylpropyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine (PubChem CID 169194372) has the molecular formula C12H21N3 and a molecular weight of 207.32 g/mol. Its IUPAC name is 3-ethyl-5-(2-methylpropyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine.

Molecular Properties

Compound Name3-ethyl-5-(2-methylpropyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine
PubChem CID169194372
Molecular FormulaC12H21N3
Molecular Weight207.32 g/mol
Exact Mass207.17
IUPAC Name3-ethyl-5-(2-methylpropyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine
SMILESCCc1cnn2c1CN(CC(C)C)CC2
InChIInChI=1S/C12H21N3/c1-4-11-7-13-15-6-5-14(8-10(2)3)9-12(11)15/h7,10H,4-6,8-9H2,1-3H3
InChIKeySKZSOWZUTUCIIX-UHFFFAOYSA-N
XLogP1.92
TPSA21.06 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.32
LogP ≤ 51.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-ethyl-5-(2-methylpropyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine?
The IUPAC name of 3-ethyl-5-(2-methylpropyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine (CID 169194372) is 3-ethyl-5-(2-methylpropyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine.
What is the SMILES notation for 3-ethyl-5-(2-methylpropyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine?
The canonical SMILES for 3-ethyl-5-(2-methylpropyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine is CCc1cnn2c1CN(CC(C)C)CC2.
What is the InChIKey of 3-ethyl-5-(2-methylpropyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine?
The InChIKey is SKZSOWZUTUCIIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3/c1-4-11-7-13-15-6-5-14(8-10(2)3)9-12(11)15/h7,10H,4-6,8-9H2,1-3H3.
What are the key properties of 3-ethyl-5-(2-methylpropyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine?
3-ethyl-5-(2-methylpropyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine has a molecular weight of 207.32 g/mol, XLogP of 1.92, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-5-(2-methylpropyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine is sourced from PubChem (CID 169194372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).