2-(7-fluoro-5,6-dimethoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-4,5-dihydro-1H-imidazole;hydrochloride

C15H20ClFN2O2 — CID 70434551

IUPAC2-(7-fluoro-5,6-dimethoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-4,5-dihydro-1H-imidazole;hydrochloride
SMILESCOc1c(F)cc2c(c1OC)CCCC2C1=NCCN1.Cl
InChIInChI=1S/C15H19FN2O2.ClH/c1-19-13-9-4-3-5-10(15-17-6-7-18-15)11(9)8-12(16)14(13)20-2;/h8,10H,3-7H2,1-2H3,(H,17,18);1H
InChIKeyNXVSXSQYNKNWKJ-UHFFFAOYSA-N
MW314.79 g/mol
LogP2.69
Rot. Bonds3

About 2-(7-fluoro-5,6-dimethoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-4,5-dihydro-1H-imidazole;hydrochloride

2-(7-fluoro-5,6-dimethoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-4,5-dihydro-1H-imidazole;hydrochloride (PubChem CID 70434551) has the molecular formula C15H20ClFN2O2 and a molecular weight of 314.79 g/mol. Its IUPAC name is 2-(7-fluoro-5,6-dimethoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-4,5-dihydro-1H-imidazole;hydrochloride.

Molecular Properties

Compound Name2-(7-fluoro-5,6-dimethoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-4,5-dihydro-1H-imidazole;hydrochloride
PubChem CID70434551
Molecular FormulaC15H20ClFN2O2
Molecular Weight314.79 g/mol
Exact Mass314.12
IUPAC Name2-(7-fluoro-5,6-dimethoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-4,5-dihydro-1H-imidazole;hydrochloride
SMILESCOc1c(F)cc2c(c1OC)CCCC2C1=NCCN1.Cl
InChIInChI=1S/C15H19FN2O2.ClH/c1-19-13-9-4-3-5-10(15-17-6-7-18-15)11(9)8-12(16)14(13)20-2;/h8,10H,3-7H2,1-2H3,(H,17,18);1H
InChIKeyNXVSXSQYNKNWKJ-UHFFFAOYSA-N
XLogP2.69
TPSA42.85 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.79
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(7-fluoro-5,6-dimethoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-4,5-dihydro-1H-imidazole;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(7-fluoro-5,6-dimethoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-4,5-dihydro-1H-imidazole;hydrochloride?
The IUPAC name of 2-(7-fluoro-5,6-dimethoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-4,5-dihydro-1H-imidazole;hydrochloride (CID 70434551) is 2-(7-fluoro-5,6-dimethoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-4,5-dihydro-1H-imidazole;hydrochloride.
What is the SMILES notation for 2-(7-fluoro-5,6-dimethoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-4,5-dihydro-1H-imidazole;hydrochloride?
The canonical SMILES for 2-(7-fluoro-5,6-dimethoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-4,5-dihydro-1H-imidazole;hydrochloride is COc1c(F)cc2c(c1OC)CCCC2C1=NCCN1.Cl.
What is the InChIKey of 2-(7-fluoro-5,6-dimethoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-4,5-dihydro-1H-imidazole;hydrochloride?
The InChIKey is NXVSXSQYNKNWKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19FN2O2.ClH/c1-19-13-9-4-3-5-10(15-17-6-7-18-15)11(9)8-12(16)14(13)20-2;/h8,10H,3-7H2,1-2H3,(H,17,18);1H.
What are the key properties of 2-(7-fluoro-5,6-dimethoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-4,5-dihydro-1H-imidazole;hydrochloride?
2-(7-fluoro-5,6-dimethoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-4,5-dihydro-1H-imidazole;hydrochloride has a molecular weight of 314.79 g/mol, XLogP of 2.69, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(7-fluoro-5,6-dimethoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-4,5-dihydro-1H-imidazole;hydrochloride is sourced from PubChem (CID 70434551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).