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

C13H15N3O — CID 121214971

IUPAC6-(furan-2-yl)-1-(2-methylpropyl)imidazo[2,1-e]pyrazole
SMILESCC(C)Cn1ccn2nc(-c3ccco3)cc12
InChIInChI=1S/C13H15N3O/c1-10(2)9-15-5-6-16-13(15)8-11(14-16)12-4-3-7-17-12/h3-8,10H,9H2,1-2H3
InChIKeyWJMJPBQSQVLMDI-UHFFFAOYSA-N
MW229.28 g/mol
LogP3.05
Rot. Bonds3

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

6-(furan-2-yl)-1-(2-methylpropyl)imidazo[2,1-e]pyrazole (PubChem CID 121214971) has the molecular formula C13H15N3O and a molecular weight of 229.28 g/mol. Its IUPAC name is 6-(furan-2-yl)-1-(2-methylpropyl)imidazo[2,1-e]pyrazole.

Molecular Properties

Compound Name6-(furan-2-yl)-1-(2-methylpropyl)imidazo[2,1-e]pyrazole
PubChem CID121214971
Molecular FormulaC13H15N3O
Molecular Weight229.28 g/mol
Exact Mass229.12
IUPAC Name6-(furan-2-yl)-1-(2-methylpropyl)imidazo[2,1-e]pyrazole
SMILESCC(C)Cn1ccn2nc(-c3ccco3)cc12
InChIInChI=1S/C13H15N3O/c1-10(2)9-15-5-6-16-13(15)8-11(14-16)12-4-3-7-17-12/h3-8,10H,9H2,1-2H3
InChIKeyWJMJPBQSQVLMDI-UHFFFAOYSA-N
XLogP3.05
TPSA35.37 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 53.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3-(furan-2-yl)-4-(2-methylpropyl)-1H-1,2,4-triazole-5-thione
CID 843761
4-(furan-2-yl)-2-phenyltriazole
CID 12752145
2-(furan-2-yl)-4-methyl-7-oxopyrazolo[1,5-a]pyrimidine-5-carboxylic acid
CID 82271463
1-(1-cyclopropylethyl)-3-(furan-2-yl)pyrazol-5-amine
CID 61271706
N-butan-2-yl-3-(furan-2-yl)-1-methylpyrazole-5-carboxamide
CID 42656738
N-benzyl-2-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-5-amine
CID 157038667
2-[2-(furan-2-yl)-4-oxopyrazolo[1,5-d][1,2,4]triazin-5-yl]-N-propan-2-ylacetamide
CID 22513267
1-benzyl-3-(furan-2-yl)pyrazol-5-amine
CID 15858676
2-(furan-2-yl)-7-(2-methylpropylsulfanyl)-5H-pyrazolo[1,5-d][1,2,4]triazin-4-one
CID 50786580
3-(furan-2-yl)-N-(2-hydroxypropyl)-1-phenylpyrazole-5-carboxamide
CID 78855996
2-[2-(furan-2-yl)-4-oxopyrazolo[1,5-d][1,2,4]triazin-5-yl]-N-(1-phenylethyl)acetamide
CID 22513269
1-(2,4-dimethylphenyl)-3-(furan-2-yl)-N-(3-methylbutyl)pyrazole-5-carboxamide
CID 1053825

Frequently Asked Questions

What is the IUPAC name of 6-(furan-2-yl)-1-(2-methylpropyl)imidazo[2,1-e]pyrazole?
The IUPAC name of 6-(furan-2-yl)-1-(2-methylpropyl)imidazo[2,1-e]pyrazole (CID 121214971) is 6-(furan-2-yl)-1-(2-methylpropyl)imidazo[2,1-e]pyrazole.
What is the SMILES notation for 6-(furan-2-yl)-1-(2-methylpropyl)imidazo[2,1-e]pyrazole?
The canonical SMILES for 6-(furan-2-yl)-1-(2-methylpropyl)imidazo[2,1-e]pyrazole is CC(C)Cn1ccn2nc(-c3ccco3)cc12.
What is the InChIKey of 6-(furan-2-yl)-1-(2-methylpropyl)imidazo[2,1-e]pyrazole?
The InChIKey is WJMJPBQSQVLMDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O/c1-10(2)9-15-5-6-16-13(15)8-11(14-16)12-4-3-7-17-12/h3-8,10H,9H2,1-2H3.
What are the key properties of 6-(furan-2-yl)-1-(2-methylpropyl)imidazo[2,1-e]pyrazole?
6-(furan-2-yl)-1-(2-methylpropyl)imidazo[2,1-e]pyrazole has a molecular weight of 229.28 g/mol, XLogP of 3.05, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(furan-2-yl)-1-(2-methylpropyl)imidazo[2,1-e]pyrazole is sourced from PubChem (CID 121214971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).