2-(4-methoxyphenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;hydrobromide

C13H15BrN2O — CID 6603264

IUPAC2-(4-methoxyphenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;hydrobromide
SMILESBr.COc1ccc(-c2cn3c(n2)CCC3)cc1
InChIInChI=1S/C13H14N2O.BrH/c1-16-11-6-4-10(5-7-11)12-9-15-8-2-3-13(15)14-12;/h4-7,9H,2-3,8H2,1H3;1H
InChIKeyCNUAYIOESJBQRF-UHFFFAOYSA-N
MW295.18 g/mol
LogP3.08
Rot. Bonds2

About 2-(4-methoxyphenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;hydrobromide

2-(4-methoxyphenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;hydrobromide (PubChem CID 6603264) has the molecular formula C13H15BrN2O and a molecular weight of 295.18 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;hydrobromide.

Molecular Properties

Compound Name2-(4-methoxyphenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;hydrobromide
PubChem CID6603264
Molecular FormulaC13H15BrN2O
Molecular Weight295.18 g/mol
Exact Mass294.04
IUPAC Name2-(4-methoxyphenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;hydrobromide
SMILESBr.COc1ccc(-c2cn3c(n2)CCC3)cc1
InChIInChI=1S/C13H14N2O.BrH/c1-16-11-6-4-10(5-7-11)12-9-15-8-2-3-13(15)14-12;/h4-7,9H,2-3,8H2,1H3;1H
InChIKeyCNUAYIOESJBQRF-UHFFFAOYSA-N
XLogP3.08
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.18
LogP ≤ 53.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-(4-methoxyphenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;hydrobromide 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-(4-methoxyphenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;hydrobromide?
The IUPAC name of 2-(4-methoxyphenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;hydrobromide (CID 6603264) is 2-(4-methoxyphenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;hydrobromide.
What is the SMILES notation for 2-(4-methoxyphenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;hydrobromide?
The canonical SMILES for 2-(4-methoxyphenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;hydrobromide is Br.COc1ccc(-c2cn3c(n2)CCC3)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;hydrobromide?
The InChIKey is CNUAYIOESJBQRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O.BrH/c1-16-11-6-4-10(5-7-11)12-9-15-8-2-3-13(15)14-12;/h4-7,9H,2-3,8H2,1H3;1H.
What are the key properties of 2-(4-methoxyphenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;hydrobromide?
2-(4-methoxyphenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;hydrobromide has a molecular weight of 295.18 g/mol, XLogP of 3.08, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;hydrobromide is sourced from PubChem (CID 6603264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).