4-methyl-3-pyridazin-3-yloxyaniline

C11H11N3O — CID 62482845

IUPAC4-methyl-3-pyridazin-3-yloxyaniline
SMILESCc1ccc(N)cc1Oc1cccnn1
InChIInChI=1S/C11H11N3O/c1-8-4-5-9(12)7-10(8)15-11-3-2-6-13-14-11/h2-7H,12H2,1H3
InChIKeyWIDFJPCODTZVJR-UHFFFAOYSA-N
MW201.23 g/mol
LogP2.16
Rot. Bonds2

About 4-methyl-3-pyridazin-3-yloxyaniline

4-methyl-3-pyridazin-3-yloxyaniline (PubChem CID 62482845) has the molecular formula C11H11N3O and a molecular weight of 201.23 g/mol. Its IUPAC name is 4-methyl-3-pyridazin-3-yloxyaniline.

Molecular Properties

Compound Name4-methyl-3-pyridazin-3-yloxyaniline
PubChem CID62482845
Molecular FormulaC11H11N3O
Molecular Weight201.23 g/mol
Exact Mass201.09
IUPAC Name4-methyl-3-pyridazin-3-yloxyaniline
SMILESCc1ccc(N)cc1Oc1cccnn1
InChIInChI=1S/C11H11N3O/c1-8-4-5-9(12)7-10(8)15-11-3-2-6-13-14-11/h2-7H,12H2,1H3
InChIKeyWIDFJPCODTZVJR-UHFFFAOYSA-N
XLogP2.16
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.23
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

4-methyl-3-(2-methylpyrimidin-4-yl)oxyaniline
CID 62770055
4-methyl-3-(3-methylpyrazin-2-yl)oxyaniline
CID 83065097
4-(5-amino-2-methylphenoxy)-N,N-dimethylpyrimidin-2-amine
CID 64830678
3-methyl-4-pyridin-2-yloxyaniline
CID 69194589
3-amino-4-pyridazin-3-yloxybenzonitrile
CID 62482847
2-pyridazin-3-yloxy-5-(trifluoromethyl)aniline
CID 82000159
5-methyl-2-pyridazin-3-yloxybenzoic acid
CID 62481837
3-(2-chlorophenoxy)pyridazine
CID 154099494
3-(4-fluorophenoxy)-4-methylaniline
CID 102167590
1-[6-(5-amino-2-methylphenoxy)-3-pyridinyl]ethanone
CID 134828568
3-[(5-methyl-3-pyridinyl)oxy]pyridazine
CID 134117099
4-(5-amino-2-methylphenoxy)-2-ethyl-1H-pyrimidin-6-one
CID 114578659

Frequently Asked Questions

What is the IUPAC name of 4-methyl-3-pyridazin-3-yloxyaniline?
The IUPAC name of 4-methyl-3-pyridazin-3-yloxyaniline (CID 62482845) is 4-methyl-3-pyridazin-3-yloxyaniline.
What is the SMILES notation for 4-methyl-3-pyridazin-3-yloxyaniline?
The canonical SMILES for 4-methyl-3-pyridazin-3-yloxyaniline is Cc1ccc(N)cc1Oc1cccnn1.
What is the InChIKey of 4-methyl-3-pyridazin-3-yloxyaniline?
The InChIKey is WIDFJPCODTZVJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N3O/c1-8-4-5-9(12)7-10(8)15-11-3-2-6-13-14-11/h2-7H,12H2,1H3.
What are the key properties of 4-methyl-3-pyridazin-3-yloxyaniline?
4-methyl-3-pyridazin-3-yloxyaniline has a molecular weight of 201.23 g/mol, XLogP of 2.16, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-3-pyridazin-3-yloxyaniline is sourced from PubChem (CID 62482845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).