4-(5-bromo-2-methylphenoxy)-N-ethylpyridine-2-carboxamide

C15H15BrN2O2 — CID 107284547

IUPAC4-(5-bromo-2-methylphenoxy)-N-ethylpyridine-2-carboxamide
SMILESCCNC(=O)c1cc(Oc2cc(Br)ccc2C)ccn1
InChIInChI=1S/C15H15BrN2O2/c1-3-17-15(19)13-9-12(6-7-18-13)20-14-8-11(16)5-4-10(14)2/h4-9H,3H2,1-2H3,(H,17,19)
InChIKeyFPJXCZXXAMATGH-UHFFFAOYSA-N
MW335.20 g/mol
LogP3.69
Rot. Bonds4

About 4-(5-bromo-2-methylphenoxy)-N-ethylpyridine-2-carboxamide

4-(5-bromo-2-methylphenoxy)-N-ethylpyridine-2-carboxamide (PubChem CID 107284547) has the molecular formula C15H15BrN2O2 and a molecular weight of 335.20 g/mol. Its IUPAC name is 4-(5-bromo-2-methylphenoxy)-N-ethylpyridine-2-carboxamide.

Molecular Properties

Compound Name4-(5-bromo-2-methylphenoxy)-N-ethylpyridine-2-carboxamide
PubChem CID107284547
Molecular FormulaC15H15BrN2O2
Molecular Weight335.20 g/mol
Exact Mass334.03
IUPAC Name4-(5-bromo-2-methylphenoxy)-N-ethylpyridine-2-carboxamide
SMILESCCNC(=O)c1cc(Oc2cc(Br)ccc2C)ccn1
InChIInChI=1S/C15H15BrN2O2/c1-3-17-15(19)13-9-12(6-7-18-13)20-14-8-11(16)5-4-10(14)2/h4-9H,3H2,1-2H3,(H,17,19)
InChIKeyFPJXCZXXAMATGH-UHFFFAOYSA-N
XLogP3.69
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.20
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(5-bromo-2-fluorophenoxy)-N-ethylpyridine-2-carboxamide
CID 114673379
4-(2-bromo-4-methoxyphenoxy)-N-ethylpyridine-2-carboxamide
CID 104707708
3-[[2-(ethylcarbamoyl)-4-pyridinyl]oxy]pyridine-4-carboxylic acid
CID 81436631
4-(4-amino-2-chlorophenoxy)-N-ethylpyridine-2-carboxamide
CID 43517931
4-(3,4-diaminophenoxy)-N-ethylpyridine-2-carboxamide
CID 89129780
4-(5-hydrazinyl-2-methylphenoxy)-N-methylpyridine-2-carboxamide
CID 86069287
methyl 4-(5-amino-2-methylphenoxy)pyridine-2-carboxylate
CID 66284886
4-[5-(4-aminobutanoylamino)-2-methylphenoxy]-N-methylpyridine-2-carboxamide
CID 119893255
methyl 4-(2-amino-4-bromophenoxy)pyridine-2-carboxylate
CID 66287690
4-bromo-N-dodecylpyridine-2-carboxamide
CID 132587561
ethyl 3-amino-2-(5-bromo-2-methylphenoxy)pyridine-4-carboxylate
CID 107285351
3-bromo-5-(5-bromo-2-methylphenoxy)benzoic acid
CID 107286518

Frequently Asked Questions

What is the IUPAC name of 4-(5-bromo-2-methylphenoxy)-N-ethylpyridine-2-carboxamide?
The IUPAC name of 4-(5-bromo-2-methylphenoxy)-N-ethylpyridine-2-carboxamide (CID 107284547) is 4-(5-bromo-2-methylphenoxy)-N-ethylpyridine-2-carboxamide.
What is the SMILES notation for 4-(5-bromo-2-methylphenoxy)-N-ethylpyridine-2-carboxamide?
The canonical SMILES for 4-(5-bromo-2-methylphenoxy)-N-ethylpyridine-2-carboxamide is CCNC(=O)c1cc(Oc2cc(Br)ccc2C)ccn1.
What is the InChIKey of 4-(5-bromo-2-methylphenoxy)-N-ethylpyridine-2-carboxamide?
The InChIKey is FPJXCZXXAMATGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15BrN2O2/c1-3-17-15(19)13-9-12(6-7-18-13)20-14-8-11(16)5-4-10(14)2/h4-9H,3H2,1-2H3,(H,17,19).
What are the key properties of 4-(5-bromo-2-methylphenoxy)-N-ethylpyridine-2-carboxamide?
4-(5-bromo-2-methylphenoxy)-N-ethylpyridine-2-carboxamide has a molecular weight of 335.20 g/mol, XLogP of 3.69, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-bromo-2-methylphenoxy)-N-ethylpyridine-2-carboxamide is sourced from PubChem (CID 107284547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).