2-(2-naphthalen-1-ylethyl)-4,5-dihydro-1H-imidazole;hydrochloride

C15H17ClN2 — CID 3086490

IUPAC2-(2-naphthalen-1-ylethyl)-4,5-dihydro-1H-imidazole;hydrochloride
SMILESCl.c1ccc2c(CCC3=NCCN3)cccc2c1
InChIInChI=1S/C15H16N2.ClH/c1-2-7-14-12(4-1)5-3-6-13(14)8-9-15-16-10-11-17-15;/h1-7H,8-11H2,(H,16,17);1H
InChIKeyLCJARYWGUDQBBW-UHFFFAOYSA-N
MW260.77 g/mol
LogP3.20
Rot. Bonds3

About 2-(2-naphthalen-1-ylethyl)-4,5-dihydro-1H-imidazole;hydrochloride

2-(2-naphthalen-1-ylethyl)-4,5-dihydro-1H-imidazole;hydrochloride (PubChem CID 3086490) has the molecular formula C15H17ClN2 and a molecular weight of 260.77 g/mol. Its IUPAC name is 2-(2-naphthalen-1-ylethyl)-4,5-dihydro-1H-imidazole;hydrochloride.

Molecular Properties

Compound Name2-(2-naphthalen-1-ylethyl)-4,5-dihydro-1H-imidazole;hydrochloride
PubChem CID3086490
Molecular FormulaC15H17ClN2
Molecular Weight260.77 g/mol
Exact Mass260.11
IUPAC Name2-(2-naphthalen-1-ylethyl)-4,5-dihydro-1H-imidazole;hydrochloride
SMILESCl.c1ccc2c(CCC3=NCCN3)cccc2c1
InChIInChI=1S/C15H16N2.ClH/c1-2-7-14-12(4-1)5-3-6-13(14)8-9-15-16-10-11-17-15;/h1-7H,8-11H2,(H,16,17);1H
InChIKeyLCJARYWGUDQBBW-UHFFFAOYSA-N
XLogP3.20
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.77
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(naphthalen-1-ylmethyl)-4,5-dihydro-1H-imidazole
CID 4436
2-[2-(2-(111C)methylphenyl)ethyl]-4,5-dihydro-1H-imidazole
CID 56935582
2-(naphthalen-1-ylmethyl)-5-tritio-4,5-dihydro-1H-imidazole
CID 87180547
ethane;2-(2-phenylethyl)-4,5-dihydro-1H-imidazole
CID 145111115
1-(4,5-dihydro-1H-imidazol-2-ylmethyl)naphthalen-2-ol;hydrochloride
CID 66855717
N-(2-naphthalen-1-ylethyl)-1,4,5,6-tetrahydropyrimidin-2-amine
CID 110915371
2-[3-chloro-2-(2-naphthalen-1-ylethyl)phenyl]-1,4,5,6-tetrahydropyrimidine;hydrochloride
CID 69239082
ethane;3-(2-naphthalen-1-ylethyl)-2-(1,4,5,6-tetrahydropyrimidin-2-yl)aniline
CID 143153163
2-(1-benzofuran-7-ylmethyl)-4,5-dihydro-1H-imidazole
CID 58951718
7-(4,5-dihydro-1H-imidazol-2-ylmethyl)-1H-indazole
CID 169281050
2-(4,5-dihydro-1H-imidazol-2-ylmethyl)aniline
CID 22493434
N,N-dimethyl-3-phenyl-3-pyridin-2-ylpropan-1-amine;2-(naphthalen-1-ylmethyl)-4,5-dihydro-1H-imidazole
CID 67438328

Frequently Asked Questions

What is the IUPAC name of 2-(2-naphthalen-1-ylethyl)-4,5-dihydro-1H-imidazole;hydrochloride?
The IUPAC name of 2-(2-naphthalen-1-ylethyl)-4,5-dihydro-1H-imidazole;hydrochloride (CID 3086490) is 2-(2-naphthalen-1-ylethyl)-4,5-dihydro-1H-imidazole;hydrochloride.
What is the SMILES notation for 2-(2-naphthalen-1-ylethyl)-4,5-dihydro-1H-imidazole;hydrochloride?
The canonical SMILES for 2-(2-naphthalen-1-ylethyl)-4,5-dihydro-1H-imidazole;hydrochloride is Cl.c1ccc2c(CCC3=NCCN3)cccc2c1.
What is the InChIKey of 2-(2-naphthalen-1-ylethyl)-4,5-dihydro-1H-imidazole;hydrochloride?
The InChIKey is LCJARYWGUDQBBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2.ClH/c1-2-7-14-12(4-1)5-3-6-13(14)8-9-15-16-10-11-17-15;/h1-7H,8-11H2,(H,16,17);1H.
What are the key properties of 2-(2-naphthalen-1-ylethyl)-4,5-dihydro-1H-imidazole;hydrochloride?
2-(2-naphthalen-1-ylethyl)-4,5-dihydro-1H-imidazole;hydrochloride has a molecular weight of 260.77 g/mol, XLogP of 3.20, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-naphthalen-1-ylethyl)-4,5-dihydro-1H-imidazole;hydrochloride is sourced from PubChem (CID 3086490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).