N-[(1-benzylimidazol-2-yl)methyl]-6-(4-fluorophenyl)pyridazin-3-amine

C21H18FN5 — CID 133324119

IUPACN-[(1-benzylimidazol-2-yl)methyl]-6-(4-fluorophenyl)pyridazin-3-amine
SMILESFc1ccc(-c2ccc(NCc3nccn3Cc3ccccc3)nn2)cc1
InChIInChI=1S/C21H18FN5/c22-18-8-6-17(7-9-18)19-10-11-20(26-25-19)24-14-21-23-12-13-27(21)15-16-4-2-1-3-5-16/h1-13H,14-15H2,(H,24,26)
InChIKeyYFHDFJBRYWUDKD-UHFFFAOYSA-N
MW359.41 g/mol
LogP4.14
Rot. Bonds6

About N-[(1-benzylimidazol-2-yl)methyl]-6-(4-fluorophenyl)pyridazin-3-amine

N-[(1-benzylimidazol-2-yl)methyl]-6-(4-fluorophenyl)pyridazin-3-amine (PubChem CID 133324119) has the molecular formula C21H18FN5 and a molecular weight of 359.41 g/mol. Its IUPAC name is N-[(1-benzylimidazol-2-yl)methyl]-6-(4-fluorophenyl)pyridazin-3-amine.

Molecular Properties

Compound NameN-[(1-benzylimidazol-2-yl)methyl]-6-(4-fluorophenyl)pyridazin-3-amine
PubChem CID133324119
Molecular FormulaC21H18FN5
Molecular Weight359.41 g/mol
Exact Mass359.15
IUPAC NameN-[(1-benzylimidazol-2-yl)methyl]-6-(4-fluorophenyl)pyridazin-3-amine
SMILESFc1ccc(-c2ccc(NCc3nccn3Cc3ccccc3)nn2)cc1
InChIInChI=1S/C21H18FN5/c22-18-8-6-17(7-9-18)19-10-11-20(26-25-19)24-14-21-23-12-13-27(21)15-16-4-2-1-3-5-16/h1-13H,14-15H2,(H,24,26)
InChIKeyYFHDFJBRYWUDKD-UHFFFAOYSA-N
XLogP4.14
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.41
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[(1-benzylimidazol-2-yl)methyl]-6-(4-fluorophenyl)pyridazin-3-amine 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

N-[(1-benzylimidazol-2-yl)methyl]-6-methylpyridazin-3-amine
CID 45219998
N-[(1-benzylimidazol-2-yl)methyl]-6-(4-fluorophenyl)-N-methylpyridazin-3-amine
CID 133324440
N-[(1-benzylimidazol-2-yl)methyl]-1-cyclopropyl-1-(4-fluorophenyl)methanamine
CID 71931133
1-[(1-benzylimidazol-2-yl)methyl]-3-ethyl-2-[(4-fluorophenyl)methyl]guanidine
CID 111794142
N-[(1-benzylimidazol-2-yl)methyl]-6-chloro-2-methylpyrimidin-4-amine
CID 133324117
N-[2-(1-benzylimidazol-2-yl)ethyl]-6-(trifluoromethyl)pyridazin-3-amine
CID 133433369
N-[2-(1-benzylpiperidin-4-yl)ethyl]-6-(4-fluorophenyl)pyridazin-3-amine
CID 10949178
N'-[(1-benzylimidazol-2-yl)methyl]-N-[2-[(1-benzylimidazol-2-yl)methylamino]ethyl]ethane-1,2-diamine
CID 57206578
(1S)-N-[(1-benzylimidazol-2-yl)methyl]-1-(3,5-difluorophenyl)ethanamine
CID 99626012
1-[(1-benzylimidazol-2-yl)methylamino]-2,2-dimethylpropan-1-ol
CID 135256386
N-[(1-benzylimidazol-2-yl)methyl]-4-methylpyrimidin-2-amine
CID 45241917
N-[(1-benzylimidazol-2-yl)methyl]ethanamine;hydrochloride
CID 45156296

Frequently Asked Questions

What is the IUPAC name of N-[(1-benzylimidazol-2-yl)methyl]-6-(4-fluorophenyl)pyridazin-3-amine?
The IUPAC name of N-[(1-benzylimidazol-2-yl)methyl]-6-(4-fluorophenyl)pyridazin-3-amine (CID 133324119) is N-[(1-benzylimidazol-2-yl)methyl]-6-(4-fluorophenyl)pyridazin-3-amine.
What is the SMILES notation for N-[(1-benzylimidazol-2-yl)methyl]-6-(4-fluorophenyl)pyridazin-3-amine?
The canonical SMILES for N-[(1-benzylimidazol-2-yl)methyl]-6-(4-fluorophenyl)pyridazin-3-amine is Fc1ccc(-c2ccc(NCc3nccn3Cc3ccccc3)nn2)cc1.
What is the InChIKey of N-[(1-benzylimidazol-2-yl)methyl]-6-(4-fluorophenyl)pyridazin-3-amine?
The InChIKey is YFHDFJBRYWUDKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18FN5/c22-18-8-6-17(7-9-18)19-10-11-20(26-25-19)24-14-21-23-12-13-27(21)15-16-4-2-1-3-5-16/h1-13H,14-15H2,(H,24,26).
What are the key properties of N-[(1-benzylimidazol-2-yl)methyl]-6-(4-fluorophenyl)pyridazin-3-amine?
N-[(1-benzylimidazol-2-yl)methyl]-6-(4-fluorophenyl)pyridazin-3-amine has a molecular weight of 359.41 g/mol, XLogP of 4.14, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-benzylimidazol-2-yl)methyl]-6-(4-fluorophenyl)pyridazin-3-amine is sourced from PubChem (CID 133324119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).