1-methyl-2-(1-piperazin-1-ylethyl)benzimidazole

C14H20N4 — CID 54914315

IUPAC1-methyl-2-(1-piperazin-1-ylethyl)benzimidazole
SMILESCC(c1nc2ccccc2n1C)N1CCNCC1
InChIInChI=1S/C14H20N4/c1-11(18-9-7-15-8-10-18)14-16-12-5-3-4-6-13(12)17(14)2/h3-6,11,15H,7-10H2,1-2H3
InChIKeyPNXJPOFQABWPLQ-UHFFFAOYSA-N
MW244.34 g/mol
LogP1.54
Rot. Bonds2

About 1-methyl-2-(1-piperazin-1-ylethyl)benzimidazole

1-methyl-2-(1-piperazin-1-ylethyl)benzimidazole (PubChem CID 54914315) has the molecular formula C14H20N4 and a molecular weight of 244.34 g/mol. Its IUPAC name is 1-methyl-2-(1-piperazin-1-ylethyl)benzimidazole.

Molecular Properties

Compound Name1-methyl-2-(1-piperazin-1-ylethyl)benzimidazole
PubChem CID54914315
Molecular FormulaC14H20N4
Molecular Weight244.34 g/mol
Exact Mass244.17
IUPAC Name1-methyl-2-(1-piperazin-1-ylethyl)benzimidazole
SMILESCC(c1nc2ccccc2n1C)N1CCNCC1
InChIInChI=1S/C14H20N4/c1-11(18-9-7-15-8-10-18)14-16-12-5-3-4-6-13(12)17(14)2/h3-6,11,15H,7-10H2,1-2H3
InChIKeyPNXJPOFQABWPLQ-UHFFFAOYSA-N
XLogP1.54
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-(1-piperazin-1-ylethyl)benzimidazole?
The IUPAC name of 1-methyl-2-(1-piperazin-1-ylethyl)benzimidazole (CID 54914315) is 1-methyl-2-(1-piperazin-1-ylethyl)benzimidazole.
What is the SMILES notation for 1-methyl-2-(1-piperazin-1-ylethyl)benzimidazole?
The canonical SMILES for 1-methyl-2-(1-piperazin-1-ylethyl)benzimidazole is CC(c1nc2ccccc2n1C)N1CCNCC1.
What is the InChIKey of 1-methyl-2-(1-piperazin-1-ylethyl)benzimidazole?
The InChIKey is PNXJPOFQABWPLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4/c1-11(18-9-7-15-8-10-18)14-16-12-5-3-4-6-13(12)17(14)2/h3-6,11,15H,7-10H2,1-2H3.
What are the key properties of 1-methyl-2-(1-piperazin-1-ylethyl)benzimidazole?
1-methyl-2-(1-piperazin-1-ylethyl)benzimidazole has a molecular weight of 244.34 g/mol, XLogP of 1.54, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-(1-piperazin-1-ylethyl)benzimidazole is sourced from PubChem (CID 54914315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).