6-(4-piperidin-1-ylpiperidin-1-yl)-1H-benzimidazole

C17H24N4 — CID 22567344

IUPAC6-(4-piperidin-1-ylpiperidin-1-yl)-1H-benzimidazole
SMILESc1nc2ccc(N3CCC(N4CCCCC4)CC3)cc2[nH]1
InChIInChI=1S/C17H24N4/c1-2-8-20(9-3-1)14-6-10-21(11-7-14)15-4-5-16-17(12-15)19-13-18-16/h4-5,12-14H,1-3,6-11H2,(H,18,19)
InChIKeyJDTUQLXFDQBKSX-UHFFFAOYSA-N
MW284.41 g/mol
LogP3.02
Rot. Bonds2

About 6-(4-piperidin-1-ylpiperidin-1-yl)-1H-benzimidazole

6-(4-piperidin-1-ylpiperidin-1-yl)-1H-benzimidazole (PubChem CID 22567344) has the molecular formula C17H24N4 and a molecular weight of 284.41 g/mol. Its IUPAC name is 6-(4-piperidin-1-ylpiperidin-1-yl)-1H-benzimidazole.

Molecular Properties

Compound Name6-(4-piperidin-1-ylpiperidin-1-yl)-1H-benzimidazole
PubChem CID22567344
Molecular FormulaC17H24N4
Molecular Weight284.41 g/mol
Exact Mass284.20
IUPAC Name6-(4-piperidin-1-ylpiperidin-1-yl)-1H-benzimidazole
SMILESc1nc2ccc(N3CCC(N4CCCCC4)CC3)cc2[nH]1
InChIInChI=1S/C17H24N4/c1-2-8-20(9-3-1)14-6-10-21(11-7-14)15-4-5-16-17(12-15)19-13-18-16/h4-5,12-14H,1-3,6-11H2,(H,18,19)
InChIKeyJDTUQLXFDQBKSX-UHFFFAOYSA-N
XLogP3.02
TPSA35.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.41
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-(4-piperidin-1-ylpiperidin-1-yl)-1H-benzimidazole 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 6-(4-piperidin-1-ylpiperidin-1-yl)-1H-benzimidazole?
The IUPAC name of 6-(4-piperidin-1-ylpiperidin-1-yl)-1H-benzimidazole (CID 22567344) is 6-(4-piperidin-1-ylpiperidin-1-yl)-1H-benzimidazole.
What is the SMILES notation for 6-(4-piperidin-1-ylpiperidin-1-yl)-1H-benzimidazole?
The canonical SMILES for 6-(4-piperidin-1-ylpiperidin-1-yl)-1H-benzimidazole is c1nc2ccc(N3CCC(N4CCCCC4)CC3)cc2[nH]1.
What is the InChIKey of 6-(4-piperidin-1-ylpiperidin-1-yl)-1H-benzimidazole?
The InChIKey is JDTUQLXFDQBKSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N4/c1-2-8-20(9-3-1)14-6-10-21(11-7-14)15-4-5-16-17(12-15)19-13-18-16/h4-5,12-14H,1-3,6-11H2,(H,18,19).
What are the key properties of 6-(4-piperidin-1-ylpiperidin-1-yl)-1H-benzimidazole?
6-(4-piperidin-1-ylpiperidin-1-yl)-1H-benzimidazole has a molecular weight of 284.41 g/mol, XLogP of 3.02, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-piperidin-1-ylpiperidin-1-yl)-1H-benzimidazole is sourced from PubChem (CID 22567344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).