3-(2,5-dichlorophenyl)pyridine-2,6-diamine

C11H9Cl2N3 — CID 66637020

IUPAC3-(2,5-dichlorophenyl)pyridine-2,6-diamine
SMILESNc1ccc(-c2cc(Cl)ccc2Cl)c(N)n1
InChIInChI=1S/C11H9Cl2N3/c12-6-1-3-9(13)8(5-6)7-2-4-10(14)16-11(7)15/h1-5H,(H4,14,15,16)
InChIKeyUASLKTYNGGLZDH-UHFFFAOYSA-N
MW254.12 g/mol
LogP3.22
Rot. Bonds1

About 3-(2,5-dichlorophenyl)pyridine-2,6-diamine

3-(2,5-dichlorophenyl)pyridine-2,6-diamine (PubChem CID 66637020) has the molecular formula C11H9Cl2N3 and a molecular weight of 254.12 g/mol. Its IUPAC name is 3-(2,5-dichlorophenyl)pyridine-2,6-diamine.

Molecular Properties

Compound Name3-(2,5-dichlorophenyl)pyridine-2,6-diamine
PubChem CID66637020
Molecular FormulaC11H9Cl2N3
Molecular Weight254.12 g/mol
Exact Mass253.02
IUPAC Name3-(2,5-dichlorophenyl)pyridine-2,6-diamine
SMILESNc1ccc(-c2cc(Cl)ccc2Cl)c(N)n1
InChIInChI=1S/C11H9Cl2N3/c12-6-1-3-9(13)8(5-6)7-2-4-10(14)16-11(7)15/h1-5H,(H4,14,15,16)
InChIKeyUASLKTYNGGLZDH-UHFFFAOYSA-N
XLogP3.22
TPSA64.93 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.12
LogP ≤ 53.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(2,5-dichlorophenyl)pyridine-2,6-diamine?
The IUPAC name of 3-(2,5-dichlorophenyl)pyridine-2,6-diamine (CID 66637020) is 3-(2,5-dichlorophenyl)pyridine-2,6-diamine.
What is the SMILES notation for 3-(2,5-dichlorophenyl)pyridine-2,6-diamine?
The canonical SMILES for 3-(2,5-dichlorophenyl)pyridine-2,6-diamine is Nc1ccc(-c2cc(Cl)ccc2Cl)c(N)n1.
What is the InChIKey of 3-(2,5-dichlorophenyl)pyridine-2,6-diamine?
The InChIKey is UASLKTYNGGLZDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9Cl2N3/c12-6-1-3-9(13)8(5-6)7-2-4-10(14)16-11(7)15/h1-5H,(H4,14,15,16).
What are the key properties of 3-(2,5-dichlorophenyl)pyridine-2,6-diamine?
3-(2,5-dichlorophenyl)pyridine-2,6-diamine has a molecular weight of 254.12 g/mol, XLogP of 3.22, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,5-dichlorophenyl)pyridine-2,6-diamine is sourced from PubChem (CID 66637020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).