5-bromo-3-chloro-2-(3-methyl-4-propan-2-ylphenoxy)pyridine

C15H15BrClNO — CID 103583561

IUPAC5-bromo-3-chloro-2-(3-methyl-4-propan-2-ylphenoxy)pyridine
SMILESCc1cc(Oc2ncc(Br)cc2Cl)ccc1C(C)C
InChIInChI=1S/C15H15BrClNO/c1-9(2)13-5-4-12(6-10(13)3)19-15-14(17)7-11(16)8-18-15/h4-9H,1-3H3
InChIKeyYYPALTTVTOIFFI-UHFFFAOYSA-N
MW340.65 g/mol
LogP5.72
Rot. Bonds3

About 5-bromo-3-chloro-2-(3-methyl-4-propan-2-ylphenoxy)pyridine

5-bromo-3-chloro-2-(3-methyl-4-propan-2-ylphenoxy)pyridine (PubChem CID 103583561) has the molecular formula C15H15BrClNO and a molecular weight of 340.65 g/mol. Its IUPAC name is 5-bromo-3-chloro-2-(3-methyl-4-propan-2-ylphenoxy)pyridine.

Molecular Properties

Compound Name5-bromo-3-chloro-2-(3-methyl-4-propan-2-ylphenoxy)pyridine
PubChem CID103583561
Molecular FormulaC15H15BrClNO
Molecular Weight340.65 g/mol
Exact Mass339.00
IUPAC Name5-bromo-3-chloro-2-(3-methyl-4-propan-2-ylphenoxy)pyridine
SMILESCc1cc(Oc2ncc(Br)cc2Cl)ccc1C(C)C
InChIInChI=1S/C15H15BrClNO/c1-9(2)13-5-4-12(6-10(13)3)19-15-14(17)7-11(16)8-18-15/h4-9H,1-3H3
InChIKeyYYPALTTVTOIFFI-UHFFFAOYSA-N
XLogP5.72
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500340.65
LogP ≤ 55.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-chloro-3-fluoro-2-(3-methyl-4-propan-2-ylphenoxy)pyridine
CID 79727500
2-[4-[(5-bromo-3-chloro-2-pyridinyl)oxy]phenoxy]propanoic acid
CID 19704700
4-chloro-5-methyl-6-(3-methyl-4-propan-2-ylphenoxy)pyrimidine
CID 63736409
5-bromo-3-chloro-2-(3,4-difluorophenoxy)pyridine
CID 103583644
3-chloro-4-(3-methyl-4-propan-2-ylphenoxy)-1,2,5-thiadiazole
CID 63506599
5-bromo-3-chloro-2-(4-fluorophenoxy)pyridine
CID 103583572
5-bromo-3-chloro-2-(4-iodophenoxy)pyridine
CID 103582296
5-methyl-4-(3-methyl-4-propan-2-ylphenoxy)pyrimidin-2-amine
CID 80863693
6-chloro-2-(3-methyl-4-propan-2-ylphenoxy)pyridin-3-amine
CID 115474420
5-amino-6-(3-methyl-4-propan-2-ylphenoxy)pyridine-3-carbonitrile
CID 103469460
5-bromo-3-chloro-2-(2-chloro-4-methylphenoxy)pyridine
CID 103583695
4-[(5-bromo-3-chloro-2-pyridinyl)oxy]benzonitrile
CID 103583574

Frequently Asked Questions

What is the IUPAC name of 5-bromo-3-chloro-2-(3-methyl-4-propan-2-ylphenoxy)pyridine?
The IUPAC name of 5-bromo-3-chloro-2-(3-methyl-4-propan-2-ylphenoxy)pyridine (CID 103583561) is 5-bromo-3-chloro-2-(3-methyl-4-propan-2-ylphenoxy)pyridine.
What is the SMILES notation for 5-bromo-3-chloro-2-(3-methyl-4-propan-2-ylphenoxy)pyridine?
The canonical SMILES for 5-bromo-3-chloro-2-(3-methyl-4-propan-2-ylphenoxy)pyridine is Cc1cc(Oc2ncc(Br)cc2Cl)ccc1C(C)C.
What is the InChIKey of 5-bromo-3-chloro-2-(3-methyl-4-propan-2-ylphenoxy)pyridine?
The InChIKey is YYPALTTVTOIFFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15BrClNO/c1-9(2)13-5-4-12(6-10(13)3)19-15-14(17)7-11(16)8-18-15/h4-9H,1-3H3.
What are the key properties of 5-bromo-3-chloro-2-(3-methyl-4-propan-2-ylphenoxy)pyridine?
5-bromo-3-chloro-2-(3-methyl-4-propan-2-ylphenoxy)pyridine has a molecular weight of 340.65 g/mol, XLogP of 5.72, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-3-chloro-2-(3-methyl-4-propan-2-ylphenoxy)pyridine is sourced from PubChem (CID 103583561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).