2-(5-fluoro-2-methoxyphenyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine;dihydrochloride

C13H16Cl2FN3O — CID 154901265

IUPAC2-(5-fluoro-2-methoxyphenyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine;dihydrochloride
SMILESCOc1ccc(F)cc1-c1nc2c([nH]1)CNCC2.Cl.Cl
InChIInChI=1S/C13H14FN3O.2ClH/c1-18-12-3-2-8(14)6-9(12)13-16-10-4-5-15-7-11(10)17-13;;/h2-3,6,15H,4-5,7H2,1H3,(H,16,17);2*1H
InChIKeyUTGUZUFFBQXDEN-UHFFFAOYSA-N
MW320.19 g/mol
LogP2.71
Rot. Bonds2

About 2-(5-fluoro-2-methoxyphenyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine;dihydrochloride

2-(5-fluoro-2-methoxyphenyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine;dihydrochloride (PubChem CID 154901265) has the molecular formula C13H16Cl2FN3O and a molecular weight of 320.19 g/mol. Its IUPAC name is 2-(5-fluoro-2-methoxyphenyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine;dihydrochloride.

Molecular Properties

Compound Name2-(5-fluoro-2-methoxyphenyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine;dihydrochloride
PubChem CID154901265
Molecular FormulaC13H16Cl2FN3O
Molecular Weight320.19 g/mol
Exact Mass319.07
IUPAC Name2-(5-fluoro-2-methoxyphenyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine;dihydrochloride
SMILESCOc1ccc(F)cc1-c1nc2c([nH]1)CNCC2.Cl.Cl
InChIInChI=1S/C13H14FN3O.2ClH/c1-18-12-3-2-8(14)6-9(12)13-16-10-4-5-15-7-11(10)17-13;;/h2-3,6,15H,4-5,7H2,1H3,(H,16,17);2*1H
InChIKeyUTGUZUFFBQXDEN-UHFFFAOYSA-N
XLogP2.71
TPSA49.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.19
LogP ≤ 52.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(5-fluoro-2-methoxyphenyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine;dihydrochloride with MolForge

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

Launch Full Analysis

Related Compounds

2-(2,3-dimethoxy-5-methylphenyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine;dihydrochloride
CID 154899672
2-(2-butoxy-5-methylphenyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine;dihydrochloride
CID 154898940
2-(2-butoxy-5-methylphenyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine
CID 72839524
2-(2-chlorophenyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine;hydrochloride
CID 156786860
2-(4-bromo-2-chlorophenyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine
CID 156786901
2-(5-fluoro-2-methoxyphenyl)-1H-imidazole
CID 55254368
5-(5-fluoro-2-methoxyphenyl)-N-methoxy-1H-1,2,4-triazol-3-amine
CID 156565763
4-(5-fluoro-2-methoxyphenyl)cyclohex-3-en-1-one
CID 83261329
5-[(5-fluoro-2-methoxyphenyl)methyl]-2-(3-fluorophenyl)-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 74244350
2-(3-propoxyphenyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine;dihydrochloride
CID 154898950
[5-(5-fluoro-2-methoxyphenyl)-1H-imidazol-2-yl]methanol
CID 116878261
2-(5-bromothiophen-2-yl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine
CID 117166985

Frequently Asked Questions

What is the IUPAC name of 2-(5-fluoro-2-methoxyphenyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine;dihydrochloride?
The IUPAC name of 2-(5-fluoro-2-methoxyphenyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine;dihydrochloride (CID 154901265) is 2-(5-fluoro-2-methoxyphenyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine;dihydrochloride.
What is the SMILES notation for 2-(5-fluoro-2-methoxyphenyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine;dihydrochloride?
The canonical SMILES for 2-(5-fluoro-2-methoxyphenyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine;dihydrochloride is COc1ccc(F)cc1-c1nc2c([nH]1)CNCC2.Cl.Cl.
What is the InChIKey of 2-(5-fluoro-2-methoxyphenyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine;dihydrochloride?
The InChIKey is UTGUZUFFBQXDEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14FN3O.2ClH/c1-18-12-3-2-8(14)6-9(12)13-16-10-4-5-15-7-11(10)17-13;;/h2-3,6,15H,4-5,7H2,1H3,(H,16,17);2*1H.
What are the key properties of 2-(5-fluoro-2-methoxyphenyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine;dihydrochloride?
2-(5-fluoro-2-methoxyphenyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine;dihydrochloride has a molecular weight of 320.19 g/mol, XLogP of 2.71, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-fluoro-2-methoxyphenyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine;dihydrochloride is sourced from PubChem (CID 154901265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).