5-chloro-2-[(6-methoxy-2-pyridinyl)oxy]aniline

C12H11ClN2O2 — CID 63591487

IUPAC5-chloro-2-[(6-methoxy-2-pyridinyl)oxy]aniline
SMILESCOc1cccc(Oc2ccc(Cl)cc2N)n1
InChIInChI=1S/C12H11ClN2O2/c1-16-11-3-2-4-12(15-11)17-10-6-5-8(13)7-9(10)14/h2-7H,14H2,1H3
InChIKeyWYMIOJOIXLDKLT-UHFFFAOYSA-N
MW250.69 g/mol
LogP3.12
Rot. Bonds3

About 5-chloro-2-[(6-methoxy-2-pyridinyl)oxy]aniline

5-chloro-2-[(6-methoxy-2-pyridinyl)oxy]aniline (PubChem CID 63591487) has the molecular formula C12H11ClN2O2 and a molecular weight of 250.69 g/mol. Its IUPAC name is 5-chloro-2-[(6-methoxy-2-pyridinyl)oxy]aniline.

Molecular Properties

Compound Name5-chloro-2-[(6-methoxy-2-pyridinyl)oxy]aniline
PubChem CID63591487
Molecular FormulaC12H11ClN2O2
Molecular Weight250.69 g/mol
Exact Mass250.05
IUPAC Name5-chloro-2-[(6-methoxy-2-pyridinyl)oxy]aniline
SMILESCOc1cccc(Oc2ccc(Cl)cc2N)n1
InChIInChI=1S/C12H11ClN2O2/c1-16-11-3-2-4-12(15-11)17-10-6-5-8(13)7-9(10)14/h2-7H,14H2,1H3
InChIKeyWYMIOJOIXLDKLT-UHFFFAOYSA-N
XLogP3.12
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.69
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 5-chloro-2-[(6-methoxy-2-pyridinyl)oxy]aniline 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

3-amino-4-[(6-methoxy-2-pyridinyl)oxy]benzonitrile
CID 55213766
4-[(6-methoxy-2-pyridinyl)oxy]naphthalen-1-amine
CID 63692036
5-chloro-2-(4,6-dimethylpyrimidin-2-yl)oxyaniline
CID 43518893
4-chloro-2-[(6-methyl-2-pyridinyl)oxy]aniline
CID 62306214
4-(2-amino-4-chlorophenoxy)-N,N-dimethylpyrimidin-2-amine
CID 64830084
[3-chloro-4-[(6-methoxy-2-pyridinyl)oxy]phenyl]methanamine
CID 63590629
3-chloro-2-[(6-methoxy-2-pyridinyl)oxy]aniline
CID 107717898
6-(2,4-dichlorophenoxy)pyridin-2-amine
CID 80653433
5-chloro-2-methoxyaniline;hydron;chloride
CID 164511506
2-(5-bromo-4-methoxypyrimidin-2-yl)oxy-5-chloroaniline
CID 106997967
1-[5-chloro-2-[(6-methoxy-2-pyridinyl)methoxy]phenyl]ethanamine
CID 63992738
2-(2-bromo-4-methoxyphenoxy)-5-chloroaniline
CID 113443527

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-[(6-methoxy-2-pyridinyl)oxy]aniline?
The IUPAC name of 5-chloro-2-[(6-methoxy-2-pyridinyl)oxy]aniline (CID 63591487) is 5-chloro-2-[(6-methoxy-2-pyridinyl)oxy]aniline.
What is the SMILES notation for 5-chloro-2-[(6-methoxy-2-pyridinyl)oxy]aniline?
The canonical SMILES for 5-chloro-2-[(6-methoxy-2-pyridinyl)oxy]aniline is COc1cccc(Oc2ccc(Cl)cc2N)n1.
What is the InChIKey of 5-chloro-2-[(6-methoxy-2-pyridinyl)oxy]aniline?
The InChIKey is WYMIOJOIXLDKLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11ClN2O2/c1-16-11-3-2-4-12(15-11)17-10-6-5-8(13)7-9(10)14/h2-7H,14H2,1H3.
What are the key properties of 5-chloro-2-[(6-methoxy-2-pyridinyl)oxy]aniline?
5-chloro-2-[(6-methoxy-2-pyridinyl)oxy]aniline has a molecular weight of 250.69 g/mol, XLogP of 3.12, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-[(6-methoxy-2-pyridinyl)oxy]aniline is sourced from PubChem (CID 63591487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).