2-ethyl-1H-benzimidazole

C9H10N2 — CID 15807

IUPAC2-ethyl-1H-benzimidazole
SMILESCCc1nc2ccccc2[nH]1
InChIInChI=1S/C9H10N2/c1-2-9-10-7-5-3-4-6-8(7)11-9/h3-6H,2H2,1H3,(H,10,11)
InChIKeyQHCCOYAKYCWDOJ-UHFFFAOYSA-N
MW146.19 g/mol
LogP2.13
Rot. Bonds1

About 2-ethyl-1H-benzimidazole

2-ethyl-1H-benzimidazole (PubChem CID 15807) has the molecular formula C9H10N2 and a molecular weight of 146.19 g/mol. Its IUPAC name is 2-ethyl-1H-benzimidazole.

Molecular Properties

Compound Name2-ethyl-1H-benzimidazole
PubChem CID15807
Molecular FormulaC9H10N2
Molecular Weight146.19 g/mol
Exact Mass146.08
IUPAC Name2-ethyl-1H-benzimidazole
SMILESCCc1nc2ccccc2[nH]1
InChIInChI=1S/C9H10N2/c1-2-9-10-7-5-3-4-6-8(7)11-9/h3-6H,2H2,1H3,(H,10,11)
InChIKeyQHCCOYAKYCWDOJ-UHFFFAOYSA-N
XLogP2.13
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.19
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-1H-benzimidazole?
The IUPAC name of 2-ethyl-1H-benzimidazole (CID 15807) is 2-ethyl-1H-benzimidazole.
What is the SMILES notation for 2-ethyl-1H-benzimidazole?
The canonical SMILES for 2-ethyl-1H-benzimidazole is CCc1nc2ccccc2[nH]1.
What is the InChIKey of 2-ethyl-1H-benzimidazole?
The InChIKey is QHCCOYAKYCWDOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2/c1-2-9-10-7-5-3-4-6-8(7)11-9/h3-6H,2H2,1H3,(H,10,11).
What are the key properties of 2-ethyl-1H-benzimidazole?
2-ethyl-1H-benzimidazole has a molecular weight of 146.19 g/mol, XLogP of 2.13, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-1H-benzimidazole is sourced from PubChem (CID 15807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).