2-methyl-6-(1-piperazin-1-ylethyl)-1H-benzimidazole

C14H20N4 — CID 82497698

IUPAC2-methyl-6-(1-piperazin-1-ylethyl)-1H-benzimidazole
SMILESCc1nc2ccc(C(C)N3CCNCC3)cc2[nH]1
InChIInChI=1S/C14H20N4/c1-10(18-7-5-15-6-8-18)12-3-4-13-14(9-12)17-11(2)16-13/h3-4,9-10,15H,5-8H2,1-2H3,(H,16,17)
InChIKeySAGKRVWUKYGPRI-UHFFFAOYSA-N
MW244.34 g/mol
LogP1.84
Rot. Bonds2

About 2-methyl-6-(1-piperazin-1-ylethyl)-1H-benzimidazole

2-methyl-6-(1-piperazin-1-ylethyl)-1H-benzimidazole (PubChem CID 82497698) has the molecular formula C14H20N4 and a molecular weight of 244.34 g/mol. Its IUPAC name is 2-methyl-6-(1-piperazin-1-ylethyl)-1H-benzimidazole.

Molecular Properties

Compound Name2-methyl-6-(1-piperazin-1-ylethyl)-1H-benzimidazole
PubChem CID82497698
Molecular FormulaC14H20N4
Molecular Weight244.34 g/mol
Exact Mass244.17
IUPAC Name2-methyl-6-(1-piperazin-1-ylethyl)-1H-benzimidazole
SMILESCc1nc2ccc(C(C)N3CCNCC3)cc2[nH]1
InChIInChI=1S/C14H20N4/c1-10(18-7-5-15-6-8-18)12-3-4-13-14(9-12)17-11(2)16-13/h3-4,9-10,15H,5-8H2,1-2H3,(H,16,17)
InChIKeySAGKRVWUKYGPRI-UHFFFAOYSA-N
XLogP1.84
TPSA43.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-methyl-6-(1-piperazin-1-ylethyl)-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

Related Compounds

2-methyl-6-propan-2-yl-1H-benzimidazole
CID 21069154
6-[(1S)-1-piperazin-1-ylethyl]-1H-indole
CID 171277845
2-methyl-6-piperazin-1-yl-1H-benzimidazole
CID 20580687
6-[(1S)-1-piperazin-1-ylethyl]-1H-indole;dihydrochloride
CID 171277846
2-methyl-1-(2-methyl-3H-benzimidazol-5-yl)propan-1-amine
CID 82491804
1-[(1R)-1-naphthalen-2-ylethyl]piperazine
CID 93464443
1-[1-(3,4-diiodophenyl)ethyl]piperazine
CID 118911318
2-(1-piperazin-1-ylethyl)-6-(trifluoromethyl)-1H-benzimidazole
CID 81456711
methylamino-(2-methyl-3H-benzimidazol-5-yl)methanol
CID 116954709
2-methyl-N-(piperazin-1-ylmethyl)-3H-benzimidazol-5-amine
CID 115229809
5-[1-(1,4-diazepan-1-yl)ethyl]-1,3-dihydrobenzimidazol-2-one
CID 82500606
1-[(1S)-1-(3-methylphenyl)ethyl]piperazine
CID 92754613

Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-(1-piperazin-1-ylethyl)-1H-benzimidazole?
The IUPAC name of 2-methyl-6-(1-piperazin-1-ylethyl)-1H-benzimidazole (CID 82497698) is 2-methyl-6-(1-piperazin-1-ylethyl)-1H-benzimidazole.
What is the SMILES notation for 2-methyl-6-(1-piperazin-1-ylethyl)-1H-benzimidazole?
The canonical SMILES for 2-methyl-6-(1-piperazin-1-ylethyl)-1H-benzimidazole is Cc1nc2ccc(C(C)N3CCNCC3)cc2[nH]1.
What is the InChIKey of 2-methyl-6-(1-piperazin-1-ylethyl)-1H-benzimidazole?
The InChIKey is SAGKRVWUKYGPRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4/c1-10(18-7-5-15-6-8-18)12-3-4-13-14(9-12)17-11(2)16-13/h3-4,9-10,15H,5-8H2,1-2H3,(H,16,17).
What are the key properties of 2-methyl-6-(1-piperazin-1-ylethyl)-1H-benzimidazole?
2-methyl-6-(1-piperazin-1-ylethyl)-1H-benzimidazole has a molecular weight of 244.34 g/mol, XLogP of 1.84, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-(1-piperazin-1-ylethyl)-1H-benzimidazole is sourced from PubChem (CID 82497698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).