1-ethyl-2-(6-methoxy-1-benzofuran-2-yl)imidazole;hydrochloride

C14H15ClN2O2 — CID 3073611

IUPAC1-ethyl-2-(6-methoxy-1-benzofuran-2-yl)imidazole;hydrochloride
SMILESCCn1ccnc1-c1cc2ccc(OC)cc2o1.Cl
InChIInChI=1S/C14H14N2O2.ClH/c1-3-16-7-6-15-14(16)13-8-10-4-5-11(17-2)9-12(10)18-13;/h4-9H,3H2,1-2H3;1H
InChIKeySLMPMUGQEQQMMW-UHFFFAOYSA-N
MW278.74 g/mol
LogP3.75
Rot. Bonds3

About 1-ethyl-2-(6-methoxy-1-benzofuran-2-yl)imidazole;hydrochloride

1-ethyl-2-(6-methoxy-1-benzofuran-2-yl)imidazole;hydrochloride (PubChem CID 3073611) has the molecular formula C14H15ClN2O2 and a molecular weight of 278.74 g/mol. Its IUPAC name is 1-ethyl-2-(6-methoxy-1-benzofuran-2-yl)imidazole;hydrochloride.

Molecular Properties

Compound Name1-ethyl-2-(6-methoxy-1-benzofuran-2-yl)imidazole;hydrochloride
PubChem CID3073611
Molecular FormulaC14H15ClN2O2
Molecular Weight278.74 g/mol
Exact Mass278.08
IUPAC Name1-ethyl-2-(6-methoxy-1-benzofuran-2-yl)imidazole;hydrochloride
SMILESCCn1ccnc1-c1cc2ccc(OC)cc2o1.Cl
InChIInChI=1S/C14H14N2O2.ClH/c1-3-16-7-6-15-14(16)13-8-10-4-5-11(17-2)9-12(10)18-13;/h4-9H,3H2,1-2H3;1H
InChIKeySLMPMUGQEQQMMW-UHFFFAOYSA-N
XLogP3.75
TPSA40.19 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.74
LogP ≤ 53.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-2-(6-methoxy-1-benzofuran-2-yl)imidazole;hydrochloride?
The IUPAC name of 1-ethyl-2-(6-methoxy-1-benzofuran-2-yl)imidazole;hydrochloride (CID 3073611) is 1-ethyl-2-(6-methoxy-1-benzofuran-2-yl)imidazole;hydrochloride.
What is the SMILES notation for 1-ethyl-2-(6-methoxy-1-benzofuran-2-yl)imidazole;hydrochloride?
The canonical SMILES for 1-ethyl-2-(6-methoxy-1-benzofuran-2-yl)imidazole;hydrochloride is CCn1ccnc1-c1cc2ccc(OC)cc2o1.Cl.
What is the InChIKey of 1-ethyl-2-(6-methoxy-1-benzofuran-2-yl)imidazole;hydrochloride?
The InChIKey is SLMPMUGQEQQMMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O2.ClH/c1-3-16-7-6-15-14(16)13-8-10-4-5-11(17-2)9-12(10)18-13;/h4-9H,3H2,1-2H3;1H.
What are the key properties of 1-ethyl-2-(6-methoxy-1-benzofuran-2-yl)imidazole;hydrochloride?
1-ethyl-2-(6-methoxy-1-benzofuran-2-yl)imidazole;hydrochloride has a molecular weight of 278.74 g/mol, XLogP of 3.75, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-2-(6-methoxy-1-benzofuran-2-yl)imidazole;hydrochloride is sourced from PubChem (CID 3073611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).