3,5-dibromo-N-(2,4,6-trifluorophenyl)pyridin-2-amine

C11H5Br2F3N2 — CID 113413846

IUPAC3,5-dibromo-N-(2,4,6-trifluorophenyl)pyridin-2-amine
SMILESFc1cc(F)c(Nc2ncc(Br)cc2Br)c(F)c1
InChIInChI=1S/C11H5Br2F3N2/c12-5-1-7(13)11(17-4-5)18-10-8(15)2-6(14)3-9(10)16/h1-4H,(H,17,18)
InChIKeyKAQDTAHMZFSSMB-UHFFFAOYSA-N
MW381.98 g/mol
LogP4.77
Rot. Bonds2

About 3,5-dibromo-N-(2,4,6-trifluorophenyl)pyridin-2-amine

3,5-dibromo-N-(2,4,6-trifluorophenyl)pyridin-2-amine (PubChem CID 113413846) has the molecular formula C11H5Br2F3N2 and a molecular weight of 381.98 g/mol. Its IUPAC name is 3,5-dibromo-N-(2,4,6-trifluorophenyl)pyridin-2-amine.

Molecular Properties

Compound Name3,5-dibromo-N-(2,4,6-trifluorophenyl)pyridin-2-amine
PubChem CID113413846
Molecular FormulaC11H5Br2F3N2
Molecular Weight381.98 g/mol
Exact Mass379.88
IUPAC Name3,5-dibromo-N-(2,4,6-trifluorophenyl)pyridin-2-amine
SMILESFc1cc(F)c(Nc2ncc(Br)cc2Br)c(F)c1
InChIInChI=1S/C11H5Br2F3N2/c12-5-1-7(13)11(17-4-5)18-10-8(15)2-6(14)3-9(10)16/h1-4H,(H,17,18)
InChIKeyKAQDTAHMZFSSMB-UHFFFAOYSA-N
XLogP4.77
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.98
LogP ≤ 54.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-bromo-5-chloro-N-(2-chloro-4,6-difluorophenyl)pyridin-2-amine
CID 114837355
3,5-dibromo-N-(5-bromo-4-fluoro-2-methylphenyl)pyridin-2-amine
CID 107593871
3,5-dibromo-N-(3-bromo-4-fluorophenyl)pyridin-2-amine
CID 104778643
3,5-dibromo-N-[2-(3,5-difluorophenyl)ethyl]pyridin-2-amine
CID 113413696
3,5-dibromo-N-(3-fluoro-4-methoxyphenyl)pyridin-2-amine
CID 113413794
3-bromo-2-N-(2,3,5,6-tetrafluorophenyl)pyridine-2,5-diamine
CID 107643323
5-bromo-N-(2-bromo-4,6-difluorophenyl)-2-hydrazinylpyridine-3-carboxamide
CID 62243354
3-bromo-5-chloro-N-(3,5-difluorophenyl)pyridin-2-amine
CID 114836633
5-bromo-2-(2,6-dichloro-4-fluoroanilino)pyridine-3-carboxylic acid
CID 83077979
3-bromo-5-chloro-N-(2-chloro-6-fluorophenyl)pyridin-2-amine
CID 114837428
3,5-dibromo-N-(3,5-dimethoxyphenyl)pyridin-2-amine
CID 113413780
3,5-dibromo-N-(3-chlorophenyl)pyridin-2-amine
CID 13314026

Frequently Asked Questions

What is the IUPAC name of 3,5-dibromo-N-(2,4,6-trifluorophenyl)pyridin-2-amine?
The IUPAC name of 3,5-dibromo-N-(2,4,6-trifluorophenyl)pyridin-2-amine (CID 113413846) is 3,5-dibromo-N-(2,4,6-trifluorophenyl)pyridin-2-amine.
What is the SMILES notation for 3,5-dibromo-N-(2,4,6-trifluorophenyl)pyridin-2-amine?
The canonical SMILES for 3,5-dibromo-N-(2,4,6-trifluorophenyl)pyridin-2-amine is Fc1cc(F)c(Nc2ncc(Br)cc2Br)c(F)c1.
What is the InChIKey of 3,5-dibromo-N-(2,4,6-trifluorophenyl)pyridin-2-amine?
The InChIKey is KAQDTAHMZFSSMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H5Br2F3N2/c12-5-1-7(13)11(17-4-5)18-10-8(15)2-6(14)3-9(10)16/h1-4H,(H,17,18).
What are the key properties of 3,5-dibromo-N-(2,4,6-trifluorophenyl)pyridin-2-amine?
3,5-dibromo-N-(2,4,6-trifluorophenyl)pyridin-2-amine has a molecular weight of 381.98 g/mol, XLogP of 4.77, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dibromo-N-(2,4,6-trifluorophenyl)pyridin-2-amine is sourced from PubChem (CID 113413846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).