1-(4-methoxy-2-methylphenyl)-5-pyrrolidin-3-ylimidazole

C15H19N3O — CID 114719980

IUPAC1-(4-methoxy-2-methylphenyl)-5-pyrrolidin-3-ylimidazole
SMILESCOc1ccc(-n2cncc2C2CCNC2)c(C)c1
InChIInChI=1S/C15H19N3O/c1-11-7-13(19-2)3-4-14(11)18-10-17-9-15(18)12-5-6-16-8-12/h3-4,7,9-10,12,16H,5-6,8H2,1-2H3
InChIKeyJWKTYXBIVSDABU-UHFFFAOYSA-N
MW257.34 g/mol
LogP2.27
Rot. Bonds3

About 1-(4-methoxy-2-methylphenyl)-5-pyrrolidin-3-ylimidazole

1-(4-methoxy-2-methylphenyl)-5-pyrrolidin-3-ylimidazole (PubChem CID 114719980) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is 1-(4-methoxy-2-methylphenyl)-5-pyrrolidin-3-ylimidazole.

Molecular Properties

Compound Name1-(4-methoxy-2-methylphenyl)-5-pyrrolidin-3-ylimidazole
PubChem CID114719980
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC Name1-(4-methoxy-2-methylphenyl)-5-pyrrolidin-3-ylimidazole
SMILESCOc1ccc(-n2cncc2C2CCNC2)c(C)c1
InChIInChI=1S/C15H19N3O/c1-11-7-13(19-2)3-4-14(11)18-10-17-9-15(18)12-5-6-16-8-12/h3-4,7,9-10,12,16H,5-6,8H2,1-2H3
InChIKeyJWKTYXBIVSDABU-UHFFFAOYSA-N
XLogP2.27
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-(4-methoxy-2-methylphenyl)-5-pyrrolidin-3-ylimidazole with MolForge

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

Launch Full Analysis

Related Compounds

1-(4-bromo-2-methylphenyl)-5-pyrrolidin-3-ylimidazole
CID 114716753
2-[3-(4-methoxy-2-methylphenyl)imidazol-4-yl]piperidine
CID 114705681
3-[3-(3,5-dimethoxyphenyl)imidazol-4-yl]piperidine
CID 114702909
1-(5-fluoro-2-methylphenyl)-5-pyrrolidin-3-ylimidazole
CID 114716903
4-[3-(4-bromo-2-methylphenyl)imidazol-4-yl]piperidine
CID 114703160
1-(2,4-difluorophenyl)-5-pyrrolidin-3-ylimidazole
CID 114716891
5-pyrrolidin-3-yl-1-(2,4,5-trifluorophenyl)imidazole
CID 114720008
4-[3-(2,5-dimethylphenyl)imidazol-4-yl]piperidine
CID 114703213
1-(4-propan-2-ylphenyl)-5-pyrrolidin-3-ylimidazole
CID 114716402
(1R)-1-[3-(4-methoxy-2-methylphenyl)imidazol-4-yl]ethanamine
CID 104942927
1-(3-butan-2-yloxyphenyl)-5-pyrrolidin-3-ylimidazole
CID 114719747
1-(3-iodophenyl)-5-pyrrolidin-3-ylimidazole
CID 114716120

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxy-2-methylphenyl)-5-pyrrolidin-3-ylimidazole?
The IUPAC name of 1-(4-methoxy-2-methylphenyl)-5-pyrrolidin-3-ylimidazole (CID 114719980) is 1-(4-methoxy-2-methylphenyl)-5-pyrrolidin-3-ylimidazole.
What is the SMILES notation for 1-(4-methoxy-2-methylphenyl)-5-pyrrolidin-3-ylimidazole?
The canonical SMILES for 1-(4-methoxy-2-methylphenyl)-5-pyrrolidin-3-ylimidazole is COc1ccc(-n2cncc2C2CCNC2)c(C)c1.
What is the InChIKey of 1-(4-methoxy-2-methylphenyl)-5-pyrrolidin-3-ylimidazole?
The InChIKey is JWKTYXBIVSDABU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-11-7-13(19-2)3-4-14(11)18-10-17-9-15(18)12-5-6-16-8-12/h3-4,7,9-10,12,16H,5-6,8H2,1-2H3.
What are the key properties of 1-(4-methoxy-2-methylphenyl)-5-pyrrolidin-3-ylimidazole?
1-(4-methoxy-2-methylphenyl)-5-pyrrolidin-3-ylimidazole has a molecular weight of 257.34 g/mol, XLogP of 2.27, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxy-2-methylphenyl)-5-pyrrolidin-3-ylimidazole is sourced from PubChem (CID 114719980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).