3-bromo-N-(3,5-dichlorophenyl)pyridin-4-amine

C11H7BrCl2N2 — CID 104777922

IUPAC3-bromo-N-(3,5-dichlorophenyl)pyridin-4-amine
SMILESClc1cc(Cl)cc(Nc2ccncc2Br)c1
InChIInChI=1S/C11H7BrCl2N2/c12-10-6-15-2-1-11(10)16-9-4-7(13)3-8(14)5-9/h1-6H,(H,15,16)
InChIKeyXUJUWFWVBRSMAE-UHFFFAOYSA-N
MW318.00 g/mol
LogP4.89
Rot. Bonds2

About 3-bromo-N-(3,5-dichlorophenyl)pyridin-4-amine

3-bromo-N-(3,5-dichlorophenyl)pyridin-4-amine (PubChem CID 104777922) has the molecular formula C11H7BrCl2N2 and a molecular weight of 318.00 g/mol. Its IUPAC name is 3-bromo-N-(3,5-dichlorophenyl)pyridin-4-amine.

Molecular Properties

Compound Name3-bromo-N-(3,5-dichlorophenyl)pyridin-4-amine
PubChem CID104777922
Molecular FormulaC11H7BrCl2N2
Molecular Weight318.00 g/mol
Exact Mass315.92
IUPAC Name3-bromo-N-(3,5-dichlorophenyl)pyridin-4-amine
SMILESClc1cc(Cl)cc(Nc2ccncc2Br)c1
InChIInChI=1S/C11H7BrCl2N2/c12-10-6-15-2-1-11(10)16-9-4-7(13)3-8(14)5-9/h1-6H,(H,15,16)
InChIKeyXUJUWFWVBRSMAE-UHFFFAOYSA-N
XLogP4.89
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.00
LogP ≤ 54.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-bromo-N-(3-chloro-4-fluorophenyl)pyridin-4-amine
CID 104776772
3-bromo-N-(3,5-difluorophenyl)pyridin-4-amine
CID 104777967
3-bromo-N-phenylpyridin-4-amine
CID 10634327
3-bromo-N-(5-methyl-3-pyridinyl)pyridin-4-amine
CID 107586507
3-bromo-N-(4-propan-2-ylphenyl)pyridin-4-amine
CID 104777924
6-N-(3,5-dichlorophenyl)isoquinoline-5,6-diamine
CID 106947554
N-(3-bromo-4-pyridinyl)quinolin-3-amine
CID 113452158
3-[(3-bromo-4-pyridinyl)amino]benzonitrile
CID 104777953
3-bromo-N-(3-chloro-2-fluorophenyl)pyridin-4-amine
CID 104777887
3-bromo-N-(5-bromo-2,4-difluorophenyl)pyridin-4-amine
CID 102854834
3-bromo-N-(2,5-dimethylphenyl)pyridin-4-amine
CID 104777947
3-bromo-N-[3-(methoxymethyl)phenyl]pyridin-4-amine
CID 104778246

Frequently Asked Questions

What is the IUPAC name of 3-bromo-N-(3,5-dichlorophenyl)pyridin-4-amine?
The IUPAC name of 3-bromo-N-(3,5-dichlorophenyl)pyridin-4-amine (CID 104777922) is 3-bromo-N-(3,5-dichlorophenyl)pyridin-4-amine.
What is the SMILES notation for 3-bromo-N-(3,5-dichlorophenyl)pyridin-4-amine?
The canonical SMILES for 3-bromo-N-(3,5-dichlorophenyl)pyridin-4-amine is Clc1cc(Cl)cc(Nc2ccncc2Br)c1.
What is the InChIKey of 3-bromo-N-(3,5-dichlorophenyl)pyridin-4-amine?
The InChIKey is XUJUWFWVBRSMAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7BrCl2N2/c12-10-6-15-2-1-11(10)16-9-4-7(13)3-8(14)5-9/h1-6H,(H,15,16).
What are the key properties of 3-bromo-N-(3,5-dichlorophenyl)pyridin-4-amine?
3-bromo-N-(3,5-dichlorophenyl)pyridin-4-amine has a molecular weight of 318.00 g/mol, XLogP of 4.89, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-N-(3,5-dichlorophenyl)pyridin-4-amine is sourced from PubChem (CID 104777922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).