6-(4-chlorophenoxy)pyridine-3,4-diamine

C11H10ClN3O — CID 129032482

IUPAC6-(4-chlorophenoxy)pyridine-3,4-diamine
SMILESNc1cnc(Oc2ccc(Cl)cc2)cc1N
InChIInChI=1S/C11H10ClN3O/c12-7-1-3-8(4-2-7)16-11-5-9(13)10(14)6-15-11/h1-6H,14H2,(H2,13,15)
InChIKeyBPRJFYOJHAYEDG-UHFFFAOYSA-N
MW235.67 g/mol
LogP2.69
Rot. Bonds2

About 6-(4-chlorophenoxy)pyridine-3,4-diamine

6-(4-chlorophenoxy)pyridine-3,4-diamine (PubChem CID 129032482) has the molecular formula C11H10ClN3O and a molecular weight of 235.67 g/mol. Its IUPAC name is 6-(4-chlorophenoxy)pyridine-3,4-diamine.

Molecular Properties

Compound Name6-(4-chlorophenoxy)pyridine-3,4-diamine
PubChem CID129032482
Molecular FormulaC11H10ClN3O
Molecular Weight235.67 g/mol
Exact Mass235.05
IUPAC Name6-(4-chlorophenoxy)pyridine-3,4-diamine
SMILESNc1cnc(Oc2ccc(Cl)cc2)cc1N
InChIInChI=1S/C11H10ClN3O/c12-7-1-3-8(4-2-7)16-11-5-9(13)10(14)6-15-11/h1-6H,14H2,(H2,13,15)
InChIKeyBPRJFYOJHAYEDG-UHFFFAOYSA-N
XLogP2.69
TPSA74.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.67
LogP ≤ 52.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-[4-[(5-amino-2-pyridinyl)oxy]phenoxy]pyridin-3-amine
CID 102449756
[6-(4-chlorophenoxy)pyrimidin-4-yl]hydrazine
CID 80915515
3-[(5-chloro-2-pyridinyl)oxy]aniline
CID 43364009
2-[2-(4-chlorophenoxy)-4-pyridinyl]ethanamine
CID 141407855
6-(4-chlorophenoxy)pyridazin-3-amine
CID 14294273
5-chloro-2-(4-ethoxyphenoxy)pyridine
CID 66234109
6-(4-chlorophenoxy)-2-methylpyridin-3-amine
CID 79022188
5-tert-butyl-2-(4-chlorophenoxy)pyridine
CID 59464073
6-(4-chloro-2-methylphenoxy)-4-methylpyridin-3-amine
CID 18419480
2-(3-fluoro-4-methylphenoxy)-5-methylpyridin-4-amine
CID 107168502
1,4-bis(4-chlorophenoxy)benzene
CID 10996522
6-(3,4-dimethylphenoxy)-4-methylpyridin-3-amine
CID 79021050

Frequently Asked Questions

What is the IUPAC name of 6-(4-chlorophenoxy)pyridine-3,4-diamine?
The IUPAC name of 6-(4-chlorophenoxy)pyridine-3,4-diamine (CID 129032482) is 6-(4-chlorophenoxy)pyridine-3,4-diamine.
What is the SMILES notation for 6-(4-chlorophenoxy)pyridine-3,4-diamine?
The canonical SMILES for 6-(4-chlorophenoxy)pyridine-3,4-diamine is Nc1cnc(Oc2ccc(Cl)cc2)cc1N.
What is the InChIKey of 6-(4-chlorophenoxy)pyridine-3,4-diamine?
The InChIKey is BPRJFYOJHAYEDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10ClN3O/c12-7-1-3-8(4-2-7)16-11-5-9(13)10(14)6-15-11/h1-6H,14H2,(H2,13,15).
What are the key properties of 6-(4-chlorophenoxy)pyridine-3,4-diamine?
6-(4-chlorophenoxy)pyridine-3,4-diamine has a molecular weight of 235.67 g/mol, XLogP of 2.69, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-chlorophenoxy)pyridine-3,4-diamine is sourced from PubChem (CID 129032482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).