2-methoxy-5,6-dihydro-4H-pyrrolo[2,1-e]pyrazole

C7H10N2O — CID 118180756

IUPAC2-methoxy-5,6-dihydro-4H-pyrrolo[2,1-e]pyrazole
SMILESCOc1cc2n(n1)CCC2
InChIInChI=1S/C7H10N2O/c1-10-7-5-6-3-2-4-9(6)8-7/h5H,2-4H2,1H3
InChIKeyXRAMNCMHYJTBFW-UHFFFAOYSA-N
MW138.17 g/mol
LogP0.84
Rot. Bonds1

About 2-methoxy-5,6-dihydro-4H-pyrrolo[2,1-e]pyrazole

2-methoxy-5,6-dihydro-4H-pyrrolo[2,1-e]pyrazole (PubChem CID 118180756) has the molecular formula C7H10N2O and a molecular weight of 138.17 g/mol. Its IUPAC name is 2-methoxy-5,6-dihydro-4H-pyrrolo[2,1-e]pyrazole.

Molecular Properties

Compound Name2-methoxy-5,6-dihydro-4H-pyrrolo[2,1-e]pyrazole
PubChem CID118180756
Molecular FormulaC7H10N2O
Molecular Weight138.17 g/mol
Exact Mass138.08
IUPAC Name2-methoxy-5,6-dihydro-4H-pyrrolo[2,1-e]pyrazole
SMILESCOc1cc2n(n1)CCC2
InChIInChI=1S/C7H10N2O/c1-10-7-5-6-3-2-4-9(6)8-7/h5H,2-4H2,1H3
InChIKeyXRAMNCMHYJTBFW-UHFFFAOYSA-N
XLogP0.84
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.17
LogP ≤ 50.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-methoxy-5,6-dihydro-4H-pyrrolo[2,1-e]pyrazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-5,6-dihydro-4H-pyrrolo[2,1-e]pyrazole?
The IUPAC name of 2-methoxy-5,6-dihydro-4H-pyrrolo[2,1-e]pyrazole (CID 118180756) is 2-methoxy-5,6-dihydro-4H-pyrrolo[2,1-e]pyrazole.
What is the SMILES notation for 2-methoxy-5,6-dihydro-4H-pyrrolo[2,1-e]pyrazole?
The canonical SMILES for 2-methoxy-5,6-dihydro-4H-pyrrolo[2,1-e]pyrazole is COc1cc2n(n1)CCC2.
What is the InChIKey of 2-methoxy-5,6-dihydro-4H-pyrrolo[2,1-e]pyrazole?
The InChIKey is XRAMNCMHYJTBFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O/c1-10-7-5-6-3-2-4-9(6)8-7/h5H,2-4H2,1H3.
What are the key properties of 2-methoxy-5,6-dihydro-4H-pyrrolo[2,1-e]pyrazole?
2-methoxy-5,6-dihydro-4H-pyrrolo[2,1-e]pyrazole has a molecular weight of 138.17 g/mol, XLogP of 0.84, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-5,6-dihydro-4H-pyrrolo[2,1-e]pyrazole is sourced from PubChem (CID 118180756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).