2-chloro-6-(3,5-dichlorophenoxy)pyridin-4-amine

C11H7Cl3N2O — CID 114070681

IUPAC2-chloro-6-(3,5-dichlorophenoxy)pyridin-4-amine
SMILESNc1cc(Cl)nc(Oc2cc(Cl)cc(Cl)c2)c1
InChIInChI=1S/C11H7Cl3N2O/c12-6-1-7(13)3-9(2-6)17-11-5-8(15)4-10(14)16-11/h1-5H,(H2,15,16)
InChIKeyMDCOZQHIEYFXAA-UHFFFAOYSA-N
MW289.55 g/mol
LogP4.42
Rot. Bonds2

About 2-chloro-6-(3,5-dichlorophenoxy)pyridin-4-amine

2-chloro-6-(3,5-dichlorophenoxy)pyridin-4-amine (PubChem CID 114070681) has the molecular formula C11H7Cl3N2O and a molecular weight of 289.55 g/mol. Its IUPAC name is 2-chloro-6-(3,5-dichlorophenoxy)pyridin-4-amine.

Molecular Properties

Compound Name2-chloro-6-(3,5-dichlorophenoxy)pyridin-4-amine
PubChem CID114070681
Molecular FormulaC11H7Cl3N2O
Molecular Weight289.55 g/mol
Exact Mass287.96
IUPAC Name2-chloro-6-(3,5-dichlorophenoxy)pyridin-4-amine
SMILESNc1cc(Cl)nc(Oc2cc(Cl)cc(Cl)c2)c1
InChIInChI=1S/C11H7Cl3N2O/c12-6-1-7(13)3-9(2-6)17-11-5-8(15)4-10(14)16-11/h1-5H,(H2,15,16)
InChIKeyMDCOZQHIEYFXAA-UHFFFAOYSA-N
XLogP4.42
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.55
LogP ≤ 54.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

3-[(4-amino-6-chloro-2-pyridinyl)oxy]benzonitrile
CID 114070670
3-(3,5-dichlorophenoxy)-5-methylaniline
CID 112648434
2-chloro-6-naphthalen-1-yloxypyridin-4-amine
CID 56990425
4-chloro-6-(4-methylphenoxy)pyrimidin-2-amine
CID 748214
2-[4-(2-amino-6-chloropyrimidin-4-yl)oxyphenyl]propan-2-ol
CID 163247823
[6-(3,5-dichlorophenoxy)-2-propan-2-ylpyrimidin-4-yl]hydrazine
CID 80979166
4-[(2,6-dichloro-4-pyridinyl)oxy]aniline;ethane
CID 144941358
4-(6-chloro-2-iodopyrimidin-4-yl)oxyaniline
CID 133056152
2-chloro-6-[2-(dimethylamino)ethoxy]pyridin-4-amine
CID 71302501
2,4-dichloro-6-methoxypyridine
CID 59872472
4-(3,5-dichlorophenoxy)-N-ethyl-6-methylpyrimidin-2-amine
CID 80874616
6-(3,5-dichlorophenoxy)-N-methyl-2-(trifluoromethyl)pyrimidin-4-amine
CID 106774251

Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-(3,5-dichlorophenoxy)pyridin-4-amine?
The IUPAC name of 2-chloro-6-(3,5-dichlorophenoxy)pyridin-4-amine (CID 114070681) is 2-chloro-6-(3,5-dichlorophenoxy)pyridin-4-amine.
What is the SMILES notation for 2-chloro-6-(3,5-dichlorophenoxy)pyridin-4-amine?
The canonical SMILES for 2-chloro-6-(3,5-dichlorophenoxy)pyridin-4-amine is Nc1cc(Cl)nc(Oc2cc(Cl)cc(Cl)c2)c1.
What is the InChIKey of 2-chloro-6-(3,5-dichlorophenoxy)pyridin-4-amine?
The InChIKey is MDCOZQHIEYFXAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7Cl3N2O/c12-6-1-7(13)3-9(2-6)17-11-5-8(15)4-10(14)16-11/h1-5H,(H2,15,16).
What are the key properties of 2-chloro-6-(3,5-dichlorophenoxy)pyridin-4-amine?
2-chloro-6-(3,5-dichlorophenoxy)pyridin-4-amine has a molecular weight of 289.55 g/mol, XLogP of 4.42, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-(3,5-dichlorophenoxy)pyridin-4-amine is sourced from PubChem (CID 114070681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).