6-cyclopropyl-1-(2-methylpropyl)imidazo[2,1-e]pyrazole

C12H17N3 — CID 121214838

IUPAC6-cyclopropyl-1-(2-methylpropyl)imidazo[2,1-e]pyrazole
SMILESCC(C)Cn1ccn2nc(C3CC3)cc12
InChIInChI=1S/C12H17N3/c1-9(2)8-14-5-6-15-12(14)7-11(13-15)10-3-4-10/h5-7,9-10H,3-4,8H2,1-2H3
InChIKeyURLSYOZEGYJHJE-UHFFFAOYSA-N
MW203.29 g/mol
LogP2.67
Rot. Bonds3

About 6-cyclopropyl-1-(2-methylpropyl)imidazo[2,1-e]pyrazole

6-cyclopropyl-1-(2-methylpropyl)imidazo[2,1-e]pyrazole (PubChem CID 121214838) has the molecular formula C12H17N3 and a molecular weight of 203.29 g/mol. Its IUPAC name is 6-cyclopropyl-1-(2-methylpropyl)imidazo[2,1-e]pyrazole.

Molecular Properties

Compound Name6-cyclopropyl-1-(2-methylpropyl)imidazo[2,1-e]pyrazole
PubChem CID121214838
Molecular FormulaC12H17N3
Molecular Weight203.29 g/mol
Exact Mass203.14
IUPAC Name6-cyclopropyl-1-(2-methylpropyl)imidazo[2,1-e]pyrazole
SMILESCC(C)Cn1ccn2nc(C3CC3)cc12
InChIInChI=1S/C12H17N3/c1-9(2)8-14-5-6-15-12(14)7-11(13-15)10-3-4-10/h5-7,9-10H,3-4,8H2,1-2H3
InChIKeyURLSYOZEGYJHJE-UHFFFAOYSA-N
XLogP2.67
TPSA22.23 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.29
LogP ≤ 52.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-1-(2-methylpropyl)imidazo[2,1-e]pyrazole?
The IUPAC name of 6-cyclopropyl-1-(2-methylpropyl)imidazo[2,1-e]pyrazole (CID 121214838) is 6-cyclopropyl-1-(2-methylpropyl)imidazo[2,1-e]pyrazole.
What is the SMILES notation for 6-cyclopropyl-1-(2-methylpropyl)imidazo[2,1-e]pyrazole?
The canonical SMILES for 6-cyclopropyl-1-(2-methylpropyl)imidazo[2,1-e]pyrazole is CC(C)Cn1ccn2nc(C3CC3)cc12.
What is the InChIKey of 6-cyclopropyl-1-(2-methylpropyl)imidazo[2,1-e]pyrazole?
The InChIKey is URLSYOZEGYJHJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3/c1-9(2)8-14-5-6-15-12(14)7-11(13-15)10-3-4-10/h5-7,9-10H,3-4,8H2,1-2H3.
What are the key properties of 6-cyclopropyl-1-(2-methylpropyl)imidazo[2,1-e]pyrazole?
6-cyclopropyl-1-(2-methylpropyl)imidazo[2,1-e]pyrazole has a molecular weight of 203.29 g/mol, XLogP of 2.67, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-1-(2-methylpropyl)imidazo[2,1-e]pyrazole is sourced from PubChem (CID 121214838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).