N-[[6-(2-fluorophenoxy)pyridazin-3-yl]methyl]propan-2-amine

C14H16FN3O — CID 62295895

IUPACN-[[6-(2-fluorophenoxy)pyridazin-3-yl]methyl]propan-2-amine
SMILESCC(C)NCc1ccc(Oc2ccccc2F)nn1
InChIInChI=1S/C14H16FN3O/c1-10(2)16-9-11-7-8-14(18-17-11)19-13-6-4-3-5-12(13)15/h3-8,10,16H,9H2,1-2H3
InChIKeyQIBKSGUXQOKGLA-UHFFFAOYSA-N
MW261.30 g/mol
LogP2.91
Rot. Bonds5

About N-[[6-(2-fluorophenoxy)pyridazin-3-yl]methyl]propan-2-amine

N-[[6-(2-fluorophenoxy)pyridazin-3-yl]methyl]propan-2-amine (PubChem CID 62295895) has the molecular formula C14H16FN3O and a molecular weight of 261.30 g/mol. Its IUPAC name is N-[[6-(2-fluorophenoxy)pyridazin-3-yl]methyl]propan-2-amine.

Molecular Properties

Compound NameN-[[6-(2-fluorophenoxy)pyridazin-3-yl]methyl]propan-2-amine
PubChem CID62295895
Molecular FormulaC14H16FN3O
Molecular Weight261.30 g/mol
Exact Mass261.13
IUPAC NameN-[[6-(2-fluorophenoxy)pyridazin-3-yl]methyl]propan-2-amine
SMILESCC(C)NCc1ccc(Oc2ccccc2F)nn1
InChIInChI=1S/C14H16FN3O/c1-10(2)16-9-11-7-8-14(18-17-11)19-13-6-4-3-5-12(13)15/h3-8,10,16H,9H2,1-2H3
InChIKeyQIBKSGUXQOKGLA-UHFFFAOYSA-N
XLogP2.91
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.30
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[[6-(2-fluorophenoxy)pyridazin-3-yl]methyl]propan-2-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-[[6-(2-fluoro-3-methylphenoxy)pyridazin-3-yl]methyl]propan-2-amine
CID 107660920
N-[[6-(2,3-dimethylphenoxy)pyridazin-3-yl]methyl]propan-2-amine
CID 62296582
N-[[6-(2,3-difluorophenoxy)-2-pyridinyl]methyl]propan-2-amine
CID 63038557
N-[[6-(4-bromo-2,5-dichlorophenoxy)pyridazin-3-yl]methyl]propan-2-amine
CID 107660793
N-[[6-(3,4-dichlorophenoxy)pyridazin-3-yl]methyl]propan-2-amine
CID 62322260
N-[(2-fluorophenyl)methyl]-N-methyl-6-[(propan-2-ylamino)methyl]pyridazin-3-amine
CID 62294083
N-[[6-(2-methylsulfanylphenoxy)pyridazin-3-yl]methyl]cyclopropanamine
CID 63647201
N-[(6-octoxypyridazin-3-yl)methyl]propan-2-amine
CID 62290047
N-[(6-methoxypyridazin-3-yl)methyl]-1-phenylethanamine
CID 114268555
N-[[6-(2-fluoro-5-methylphenoxy)pyridazin-3-yl]methyl]ethanamine
CID 64856226
N-methyl-1-[6-(2-propoxyphenoxy)pyridazin-3-yl]methanamine
CID 62296888
N-[[6-(2-fluoro-3-methylphenoxy)pyridazin-3-yl]methyl]propan-1-amine
CID 107660862

Frequently Asked Questions

What is the IUPAC name of N-[[6-(2-fluorophenoxy)pyridazin-3-yl]methyl]propan-2-amine?
The IUPAC name of N-[[6-(2-fluorophenoxy)pyridazin-3-yl]methyl]propan-2-amine (CID 62295895) is N-[[6-(2-fluorophenoxy)pyridazin-3-yl]methyl]propan-2-amine.
What is the SMILES notation for N-[[6-(2-fluorophenoxy)pyridazin-3-yl]methyl]propan-2-amine?
The canonical SMILES for N-[[6-(2-fluorophenoxy)pyridazin-3-yl]methyl]propan-2-amine is CC(C)NCc1ccc(Oc2ccccc2F)nn1.
What is the InChIKey of N-[[6-(2-fluorophenoxy)pyridazin-3-yl]methyl]propan-2-amine?
The InChIKey is QIBKSGUXQOKGLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16FN3O/c1-10(2)16-9-11-7-8-14(18-17-11)19-13-6-4-3-5-12(13)15/h3-8,10,16H,9H2,1-2H3.
What are the key properties of N-[[6-(2-fluorophenoxy)pyridazin-3-yl]methyl]propan-2-amine?
N-[[6-(2-fluorophenoxy)pyridazin-3-yl]methyl]propan-2-amine has a molecular weight of 261.30 g/mol, XLogP of 2.91, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[6-(2-fluorophenoxy)pyridazin-3-yl]methyl]propan-2-amine is sourced from PubChem (CID 62295895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).