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

C11H8Cl2N2O — CID 735776

IUPAC6-(2,4-dichlorophenoxy)pyridin-3-amine
SMILESNc1ccc(Oc2ccc(Cl)cc2Cl)nc1
InChIInChI=1S/C11H8Cl2N2O/c12-7-1-3-10(9(13)5-7)16-11-4-2-8(14)6-15-11/h1-6H,14H2
InChIKeyXBBAKFQNAVTALV-UHFFFAOYSA-N
MW255.10 g/mol
LogP3.76
Rot. Bonds2

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

6-(2,4-dichlorophenoxy)pyridin-3-amine (PubChem CID 735776) has the molecular formula C11H8Cl2N2O and a molecular weight of 255.10 g/mol. Its IUPAC name is 6-(2,4-dichlorophenoxy)pyridin-3-amine.

Molecular Properties

Compound Name6-(2,4-dichlorophenoxy)pyridin-3-amine
PubChem CID735776
Molecular FormulaC11H8Cl2N2O
Molecular Weight255.10 g/mol
Exact Mass254.00
IUPAC Name6-(2,4-dichlorophenoxy)pyridin-3-amine
SMILESNc1ccc(Oc2ccc(Cl)cc2Cl)nc1
InChIInChI=1S/C11H8Cl2N2O/c12-7-1-3-10(9(13)5-7)16-11-4-2-8(14)6-15-11/h1-6H,14H2
InChIKeyXBBAKFQNAVTALV-UHFFFAOYSA-N
XLogP3.76
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.10
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_OC_no_alk_A(8)', 'substructure': 'N/A'}

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Related Compounds

6-(2-Fluorophenoxy)pyridin-3-amine
CID 2800656
6-(4-Chloro-3-methylphenoxy)pyridin-3-amine
CID 2800162
6-(4-Fluorophenoxy)pyridin-3-amine
CID 421224
6-Phenoxy-3-pyridinamine
CID 212856
3-Chloro-4-(2-pyridylmethoxy)aniline
CID 16781212
6-(2,6-Dichlorophenoxy)pyridin-3-amine
CID 2798074
6-(4-Chloro-3,5-dimethylphenoxy)pyridin-3-amine
CID 2798075
6-(4-Chloro-2-methylphenoxy)pyridin-3-amine
CID 2800143
1-(2-(2-Chlorophenoxy)pyridin-3-yl)piperazine
CID 46230818
N'-{[2-(2,4-dichlorophenoxy)acetyl]oxy}pyridine-2-carboximidamide
CID 9567032
2-[(2-Chlorophenoxy)methyl]pyridine
CID 25349029
1-(2-(2-Chloro-6-fluorophenoxy)pyridin-3-yl)piperazine
CID 44131666

Frequently Asked Questions

What is the IUPAC name of 6-(2,4-dichlorophenoxy)pyridin-3-amine?
The IUPAC name of 6-(2,4-dichlorophenoxy)pyridin-3-amine (CID 735776) is 6-(2,4-dichlorophenoxy)pyridin-3-amine.
What is the SMILES notation for 6-(2,4-dichlorophenoxy)pyridin-3-amine?
The canonical SMILES for 6-(2,4-dichlorophenoxy)pyridin-3-amine is Nc1ccc(Oc2ccc(Cl)cc2Cl)nc1.
What is the InChIKey of 6-(2,4-dichlorophenoxy)pyridin-3-amine?
The InChIKey is XBBAKFQNAVTALV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8Cl2N2O/c12-7-1-3-10(9(13)5-7)16-11-4-2-8(14)6-15-11/h1-6H,14H2.
What are the key properties of 6-(2,4-dichlorophenoxy)pyridin-3-amine?
6-(2,4-dichlorophenoxy)pyridin-3-amine has a molecular weight of 255.10 g/mol, XLogP of 3.76, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,4-dichlorophenoxy)pyridin-3-amine is sourced from PubChem (CID 735776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).