2,5-dimethyl-1-pyrrolidin-3-ylbenzimidazole

C13H17N3 — CID 84784214

IUPAC2,5-dimethyl-1-pyrrolidin-3-ylbenzimidazole
SMILESCc1ccc2c(c1)nc(C)n2C1CCNC1
InChIInChI=1S/C13H17N3/c1-9-3-4-13-12(7-9)15-10(2)16(13)11-5-6-14-8-11/h3-4,7,11,14H,5-6,8H2,1-2H3
InChIKeyUOXFDCWARQZTLW-UHFFFAOYSA-N
MW215.30 g/mol
LogP2.19
Rot. Bonds1

About 2,5-dimethyl-1-pyrrolidin-3-ylbenzimidazole

2,5-dimethyl-1-pyrrolidin-3-ylbenzimidazole (PubChem CID 84784214) has the molecular formula C13H17N3 and a molecular weight of 215.30 g/mol. Its IUPAC name is 2,5-dimethyl-1-pyrrolidin-3-ylbenzimidazole.

Molecular Properties

Compound Name2,5-dimethyl-1-pyrrolidin-3-ylbenzimidazole
PubChem CID84784214
Molecular FormulaC13H17N3
Molecular Weight215.30 g/mol
Exact Mass215.14
IUPAC Name2,5-dimethyl-1-pyrrolidin-3-ylbenzimidazole
SMILESCc1ccc2c(c1)nc(C)n2C1CCNC1
InChIInChI=1S/C13H17N3/c1-9-3-4-13-12(7-9)15-10(2)16(13)11-5-6-14-8-11/h3-4,7,11,14H,5-6,8H2,1-2H3
InChIKeyUOXFDCWARQZTLW-UHFFFAOYSA-N
XLogP2.19
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.30
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2,5-dimethyl-1-pyrrolidin-3-ylbenzimidazole 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

2,5-dimethyl-1-piperidin-3-ylbenzimidazole
CID 84793055
2-methyl-1-[(3S)-pyrrolidin-3-yl]benzimidazole;hydrochloride
CID 162422976
5-methyl-1-piperidin-4-ylbenzimidazol-2-amine
CID 84793876
1-[(3R,4R)-4-(2,5-dimethylbenzimidazol-1-yl)piperidin-3-yl]oxy-2-methylpropan-2-ol
CID 68507642
5,6-difluoro-2-methyl-1-piperidin-4-ylbenzimidazole
CID 82146059
2,6-dimethyl-3-piperidin-4-ylimidazo[4,5-c]pyridine
CID 58852292
4-fluoro-2-methyl-1-pyrrolidin-3-ylbenzimidazole
CID 84786770
1-cyclopropyl-2-methylbenzimidazole-5-carbonitrile
CID 28693642
N-[4-(2,5-dimethylbenzimidazol-1-yl)cyclohexyl]-2,3-dihydro-1H-inden-2-amine
CID 59135493
1-cyclopropyl-5-methyl-2-(3-methylpyrrolidin-2-yl)benzimidazole
CID 102776684
1-cyclopropyl-5-ethynyl-2-methylbenzimidazole
CID 162380804
1-cyclobutyl-5-fluoro-2-methylbenzimidazole
CID 139518340

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-1-pyrrolidin-3-ylbenzimidazole?
The IUPAC name of 2,5-dimethyl-1-pyrrolidin-3-ylbenzimidazole (CID 84784214) is 2,5-dimethyl-1-pyrrolidin-3-ylbenzimidazole.
What is the SMILES notation for 2,5-dimethyl-1-pyrrolidin-3-ylbenzimidazole?
The canonical SMILES for 2,5-dimethyl-1-pyrrolidin-3-ylbenzimidazole is Cc1ccc2c(c1)nc(C)n2C1CCNC1.
What is the InChIKey of 2,5-dimethyl-1-pyrrolidin-3-ylbenzimidazole?
The InChIKey is UOXFDCWARQZTLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3/c1-9-3-4-13-12(7-9)15-10(2)16(13)11-5-6-14-8-11/h3-4,7,11,14H,5-6,8H2,1-2H3.
What are the key properties of 2,5-dimethyl-1-pyrrolidin-3-ylbenzimidazole?
2,5-dimethyl-1-pyrrolidin-3-ylbenzimidazole has a molecular weight of 215.30 g/mol, XLogP of 2.19, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-1-pyrrolidin-3-ylbenzimidazole is sourced from PubChem (CID 84784214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).