1-naphthalen-1-ylimidazole;hydrochloride

C13H11ClN2 — CID 175383926

IUPAC1-naphthalen-1-ylimidazole;hydrochloride
SMILESCl.c1ccc2c(-n3ccnc3)cccc2c1
InChIInChI=1S/C13H10N2.ClH/c1-2-6-12-11(4-1)5-3-7-13(12)15-9-8-14-10-15;/h1-10H;1H
InChIKeyBMFUAKAYHRXSIJ-UHFFFAOYSA-N
MW230.70 g/mol
LogP3.45
Rot. Bonds1

About 1-naphthalen-1-ylimidazole;hydrochloride

1-naphthalen-1-ylimidazole;hydrochloride (PubChem CID 175383926) has the molecular formula C13H11ClN2 and a molecular weight of 230.70 g/mol. Its IUPAC name is 1-naphthalen-1-ylimidazole;hydrochloride.

Molecular Properties

Compound Name1-naphthalen-1-ylimidazole;hydrochloride
PubChem CID175383926
Molecular FormulaC13H11ClN2
Molecular Weight230.70 g/mol
Exact Mass230.06
IUPAC Name1-naphthalen-1-ylimidazole;hydrochloride
SMILESCl.c1ccc2c(-n3ccnc3)cccc2c1
InChIInChI=1S/C13H10N2.ClH/c1-2-6-12-11(4-1)5-3-7-13(12)15-9-8-14-10-15;/h1-10H;1H
InChIKeyBMFUAKAYHRXSIJ-UHFFFAOYSA-N
XLogP3.45
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.70
LogP ≤ 53.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-naphthalen-1-ylimidazole;hydrochloride?
The IUPAC name of 1-naphthalen-1-ylimidazole;hydrochloride (CID 175383926) is 1-naphthalen-1-ylimidazole;hydrochloride.
What is the SMILES notation for 1-naphthalen-1-ylimidazole;hydrochloride?
The canonical SMILES for 1-naphthalen-1-ylimidazole;hydrochloride is Cl.c1ccc2c(-n3ccnc3)cccc2c1.
What is the InChIKey of 1-naphthalen-1-ylimidazole;hydrochloride?
The InChIKey is BMFUAKAYHRXSIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N2.ClH/c1-2-6-12-11(4-1)5-3-7-13(12)15-9-8-14-10-15;/h1-10H;1H.
What are the key properties of 1-naphthalen-1-ylimidazole;hydrochloride?
1-naphthalen-1-ylimidazole;hydrochloride has a molecular weight of 230.70 g/mol, XLogP of 3.45, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-naphthalen-1-ylimidazole;hydrochloride is sourced from PubChem (CID 175383926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).