2-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)-4,5-dihydro-1H-imidazole;hydrochloride

C14H19ClN2 — CID 21390927

IUPAC2-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)-4,5-dihydro-1H-imidazole;hydrochloride
SMILESCl.c1ccc2c(c1)CCCC2CC1=NCCN1
InChIInChI=1S/C14H18N2.ClH/c1-2-7-13-11(4-1)5-3-6-12(13)10-14-15-8-9-16-14;/h1-2,4,7,12H,3,5-6,8-10H2,(H,15,16);1H
InChIKeyZYQILZFJCUQEEK-UHFFFAOYSA-N
MW250.77 g/mol
LogP2.92
Rot. Bonds2

About 2-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)-4,5-dihydro-1H-imidazole;hydrochloride

2-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)-4,5-dihydro-1H-imidazole;hydrochloride (PubChem CID 21390927) has the molecular formula C14H19ClN2 and a molecular weight of 250.77 g/mol. Its IUPAC name is 2-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)-4,5-dihydro-1H-imidazole;hydrochloride.

Molecular Properties

Compound Name2-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)-4,5-dihydro-1H-imidazole;hydrochloride
PubChem CID21390927
Molecular FormulaC14H19ClN2
Molecular Weight250.77 g/mol
Exact Mass250.12
IUPAC Name2-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)-4,5-dihydro-1H-imidazole;hydrochloride
SMILESCl.c1ccc2c(c1)CCCC2CC1=NCCN1
InChIInChI=1S/C14H18N2.ClH/c1-2-7-13-11(4-1)5-3-6-12(13)10-14-15-8-9-16-14;/h1-2,4,7,12H,3,5-6,8-10H2,(H,15,16);1H
InChIKeyZYQILZFJCUQEEK-UHFFFAOYSA-N
XLogP2.92
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.77
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(4-fluoro-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-yl)methyl]-4,5-dihydro-1H-imidazole
CID 21390938
1-[2-(1,2,3,4-tetrahydronaphthalen-1-yl)ethyl]-1,2,3,4-tetrahydronaphthalene
CID 15742901
8-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)-1,2,3,4-tetrahydroquinoline
CID 106778023
[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]methanamine;hydrochloride
CID 171991657
ethane;2-(1,2,3,4-tetrahydronaphthalen-1-yl)-4,5-dihydro-1H-imidazole
CID 91000724
7-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)-1,2,3,4-tetrahydroquinoline
CID 106778024
1-(iodomethyl)-1,2,3,4-tetrahydronaphthalene
CID 2763030
1-(bromomethyl)-1,2,3,4-tetrahydronaphthalene
CID 13067239
(1R)-1-prop-2-enyl-1,2,3,4-tetrahydronaphthalene
CID 138977422
imino(dioxido)azanium;2-(1,2,3,4-tetrahydronaphthalen-1-yl)-4,5-dihydro-1H-imidazole
CID 22388703
1-(2-methylpropyl)-1,2,3,4-tetrahydronaphthalene
CID 54453127
2-[2-hydroxyethyl(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)amino]ethanol
CID 63771637

Frequently Asked Questions

What is the IUPAC name of 2-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)-4,5-dihydro-1H-imidazole;hydrochloride?
The IUPAC name of 2-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)-4,5-dihydro-1H-imidazole;hydrochloride (CID 21390927) is 2-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)-4,5-dihydro-1H-imidazole;hydrochloride.
What is the SMILES notation for 2-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)-4,5-dihydro-1H-imidazole;hydrochloride?
The canonical SMILES for 2-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)-4,5-dihydro-1H-imidazole;hydrochloride is Cl.c1ccc2c(c1)CCCC2CC1=NCCN1.
What is the InChIKey of 2-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)-4,5-dihydro-1H-imidazole;hydrochloride?
The InChIKey is ZYQILZFJCUQEEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2.ClH/c1-2-7-13-11(4-1)5-3-6-12(13)10-14-15-8-9-16-14;/h1-2,4,7,12H,3,5-6,8-10H2,(H,15,16);1H.
What are the key properties of 2-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)-4,5-dihydro-1H-imidazole;hydrochloride?
2-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)-4,5-dihydro-1H-imidazole;hydrochloride has a molecular weight of 250.77 g/mol, XLogP of 2.92, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)-4,5-dihydro-1H-imidazole;hydrochloride is sourced from PubChem (CID 21390927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).