2-[(1-methylnaphthalen-2-yl)methyl]-4,5-dihydro-1H-imidazole;hydrochloride

C15H17ClN2 — CID 13491497

IUPAC2-[(1-methylnaphthalen-2-yl)methyl]-4,5-dihydro-1H-imidazole;hydrochloride
SMILESCc1c(CC2=NCCN2)ccc2ccccc12.Cl
InChIInChI=1S/C15H16N2.ClH/c1-11-13(10-15-16-8-9-17-15)7-6-12-4-2-3-5-14(11)12;/h2-7H,8-10H2,1H3,(H,16,17);1H
InChIKeyYNSVEKIFSKPRMF-UHFFFAOYSA-N
MW260.77 g/mol
LogP3.11
Rot. Bonds2

About 2-[(1-methylnaphthalen-2-yl)methyl]-4,5-dihydro-1H-imidazole;hydrochloride

2-[(1-methylnaphthalen-2-yl)methyl]-4,5-dihydro-1H-imidazole;hydrochloride (PubChem CID 13491497) has the molecular formula C15H17ClN2 and a molecular weight of 260.77 g/mol. Its IUPAC name is 2-[(1-methylnaphthalen-2-yl)methyl]-4,5-dihydro-1H-imidazole;hydrochloride.

Molecular Properties

Compound Name2-[(1-methylnaphthalen-2-yl)methyl]-4,5-dihydro-1H-imidazole;hydrochloride
PubChem CID13491497
Molecular FormulaC15H17ClN2
Molecular Weight260.77 g/mol
Exact Mass260.11
IUPAC Name2-[(1-methylnaphthalen-2-yl)methyl]-4,5-dihydro-1H-imidazole;hydrochloride
SMILESCc1c(CC2=NCCN2)ccc2ccccc12.Cl
InChIInChI=1S/C15H16N2.ClH/c1-11-13(10-15-16-8-9-17-15)7-6-12-4-2-3-5-14(11)12;/h2-7H,8-10H2,1H3,(H,16,17);1H
InChIKeyYNSVEKIFSKPRMF-UHFFFAOYSA-N
XLogP3.11
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.77
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[(1-methylnaphthalen-2-yl)methyl]-4,5-dihydro-1H-imidazole;hydrochloride?
The IUPAC name of 2-[(1-methylnaphthalen-2-yl)methyl]-4,5-dihydro-1H-imidazole;hydrochloride (CID 13491497) is 2-[(1-methylnaphthalen-2-yl)methyl]-4,5-dihydro-1H-imidazole;hydrochloride.
What is the SMILES notation for 2-[(1-methylnaphthalen-2-yl)methyl]-4,5-dihydro-1H-imidazole;hydrochloride?
The canonical SMILES for 2-[(1-methylnaphthalen-2-yl)methyl]-4,5-dihydro-1H-imidazole;hydrochloride is Cc1c(CC2=NCCN2)ccc2ccccc12.Cl.
What is the InChIKey of 2-[(1-methylnaphthalen-2-yl)methyl]-4,5-dihydro-1H-imidazole;hydrochloride?
The InChIKey is YNSVEKIFSKPRMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2.ClH/c1-11-13(10-15-16-8-9-17-15)7-6-12-4-2-3-5-14(11)12;/h2-7H,8-10H2,1H3,(H,16,17);1H.
What are the key properties of 2-[(1-methylnaphthalen-2-yl)methyl]-4,5-dihydro-1H-imidazole;hydrochloride?
2-[(1-methylnaphthalen-2-yl)methyl]-4,5-dihydro-1H-imidazole;hydrochloride has a molecular weight of 260.77 g/mol, XLogP of 3.11, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1-methylnaphthalen-2-yl)methyl]-4,5-dihydro-1H-imidazole;hydrochloride is sourced from PubChem (CID 13491497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).