1,6-dimethyl-2-piperidin-2-ylbenzimidazole

C14H19N3 — CID 83857900

IUPAC1,6-dimethyl-2-piperidin-2-ylbenzimidazole
SMILESCc1ccc2nc(C3CCCCN3)n(C)c2c1
InChIInChI=1S/C14H19N3/c1-10-6-7-11-13(9-10)17(2)14(16-11)12-5-3-4-8-15-12/h6-7,9,12,15H,3-5,8H2,1-2H3
InChIKeyQVDCKJXWVBGTSM-UHFFFAOYSA-N
MW229.33 g/mol
LogP2.70
Rot. Bonds1

About 1,6-dimethyl-2-piperidin-2-ylbenzimidazole

1,6-dimethyl-2-piperidin-2-ylbenzimidazole (PubChem CID 83857900) has the molecular formula C14H19N3 and a molecular weight of 229.33 g/mol. Its IUPAC name is 1,6-dimethyl-2-piperidin-2-ylbenzimidazole.

Molecular Properties

Compound Name1,6-dimethyl-2-piperidin-2-ylbenzimidazole
PubChem CID83857900
Molecular FormulaC14H19N3
Molecular Weight229.33 g/mol
Exact Mass229.16
IUPAC Name1,6-dimethyl-2-piperidin-2-ylbenzimidazole
SMILESCc1ccc2nc(C3CCCCN3)n(C)c2c1
InChIInChI=1S/C14H19N3/c1-10-6-7-11-13(9-10)17(2)14(16-11)12-5-3-4-8-15-12/h6-7,9,12,15H,3-5,8H2,1-2H3
InChIKeyQVDCKJXWVBGTSM-UHFFFAOYSA-N
XLogP2.70
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.33
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1,6-dimethyl-2-piperidin-2-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

3-methyl-2-piperidin-2-ylbenzimidazole-5-carbonitrile
CID 84629728
6-tert-butyl-1-methyl-2-pyrrolidin-2-ylbenzimidazole
CID 84636801
1,5,7-trimethyl-2-piperidin-2-ylbenzimidazole
CID 84631010
5-fluoro-1-methyl-2-[(2S)-pyrrolidin-2-yl]benzimidazole
CID 83857852
1,6-dimethyl-2-(pyrrolidin-2-ylmethyl)benzimidazole
CID 83858076
2-(azocan-2-yl)-1-methylimidazo[4,5-b]pyridine
CID 114239785
2-(4-ethylpiperidin-2-yl)-1,5-dimethylbenzimidazole
CID 114427691
2-(azepan-2-yl)-1-propan-2-ylbenzimidazole
CID 64559378
2-(6-methylnaphthalen-2-yl)piperidine
CID 116962309
5-methyl-2-piperidin-2-yl-1,3-benzoxazole
CID 60918725
3-(4-methylphenyl)-2-piperidin-2-ylimidazo[4,5-b]pyridine
CID 117163089
5-bromo-1-ethyl-2-piperidin-2-ylbenzimidazole
CID 60784120

Frequently Asked Questions

What is the IUPAC name of 1,6-dimethyl-2-piperidin-2-ylbenzimidazole?
The IUPAC name of 1,6-dimethyl-2-piperidin-2-ylbenzimidazole (CID 83857900) is 1,6-dimethyl-2-piperidin-2-ylbenzimidazole.
What is the SMILES notation for 1,6-dimethyl-2-piperidin-2-ylbenzimidazole?
The canonical SMILES for 1,6-dimethyl-2-piperidin-2-ylbenzimidazole is Cc1ccc2nc(C3CCCCN3)n(C)c2c1.
What is the InChIKey of 1,6-dimethyl-2-piperidin-2-ylbenzimidazole?
The InChIKey is QVDCKJXWVBGTSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3/c1-10-6-7-11-13(9-10)17(2)14(16-11)12-5-3-4-8-15-12/h6-7,9,12,15H,3-5,8H2,1-2H3.
What are the key properties of 1,6-dimethyl-2-piperidin-2-ylbenzimidazole?
1,6-dimethyl-2-piperidin-2-ylbenzimidazole has a molecular weight of 229.33 g/mol, XLogP of 2.70, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,6-dimethyl-2-piperidin-2-ylbenzimidazole is sourced from PubChem (CID 83857900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).