2,4-dichloro-1-cyclobutylbenzimidazole

C11H10Cl2N2 — CID 84800761

IUPAC2,4-dichloro-1-cyclobutylbenzimidazole
SMILESClc1cccc2c1nc(Cl)n2C1CCC1
InChIInChI=1S/C11H10Cl2N2/c12-8-5-2-6-9-10(8)14-11(13)15(9)7-3-1-4-7/h2,5-7H,1,3-4H2
InChIKeyVXPXVRFJHNHCON-UHFFFAOYSA-N
MW241.12 g/mol
LogP4.07
Rot. Bonds1

About 2,4-dichloro-1-cyclobutylbenzimidazole

2,4-dichloro-1-cyclobutylbenzimidazole (PubChem CID 84800761) has the molecular formula C11H10Cl2N2 and a molecular weight of 241.12 g/mol. Its IUPAC name is 2,4-dichloro-1-cyclobutylbenzimidazole.

Molecular Properties

Compound Name2,4-dichloro-1-cyclobutylbenzimidazole
PubChem CID84800761
Molecular FormulaC11H10Cl2N2
Molecular Weight241.12 g/mol
Exact Mass240.02
IUPAC Name2,4-dichloro-1-cyclobutylbenzimidazole
SMILESClc1cccc2c1nc(Cl)n2C1CCC1
InChIInChI=1S/C11H10Cl2N2/c12-8-5-2-6-9-10(8)14-11(13)15(9)7-3-1-4-7/h2,5-7H,1,3-4H2
InChIKeyVXPXVRFJHNHCON-UHFFFAOYSA-N
XLogP4.07
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.12
LogP ≤ 54.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-1-cyclobutylbenzimidazole?
The IUPAC name of 2,4-dichloro-1-cyclobutylbenzimidazole (CID 84800761) is 2,4-dichloro-1-cyclobutylbenzimidazole.
What is the SMILES notation for 2,4-dichloro-1-cyclobutylbenzimidazole?
The canonical SMILES for 2,4-dichloro-1-cyclobutylbenzimidazole is Clc1cccc2c1nc(Cl)n2C1CCC1.
What is the InChIKey of 2,4-dichloro-1-cyclobutylbenzimidazole?
The InChIKey is VXPXVRFJHNHCON-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10Cl2N2/c12-8-5-2-6-9-10(8)14-11(13)15(9)7-3-1-4-7/h2,5-7H,1,3-4H2.
What are the key properties of 2,4-dichloro-1-cyclobutylbenzimidazole?
2,4-dichloro-1-cyclobutylbenzimidazole has a molecular weight of 241.12 g/mol, XLogP of 4.07, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-1-cyclobutylbenzimidazole is sourced from PubChem (CID 84800761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).