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

C14H12BrFN2O2 — CID 114673379

IUPAC4-(5-bromo-2-fluorophenoxy)-N-ethylpyridine-2-carboxamide
SMILESCCNC(=O)c1cc(Oc2cc(Br)ccc2F)ccn1
InChIInChI=1S/C14H12BrFN2O2/c1-2-17-14(19)12-8-10(5-6-18-12)20-13-7-9(15)3-4-11(13)16/h3-8H,2H2,1H3,(H,17,19)
InChIKeyYCRPXIUJTZGFTM-UHFFFAOYSA-N
MW339.16 g/mol
LogP3.53
Rot. Bonds4

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

4-(5-bromo-2-fluorophenoxy)-N-ethylpyridine-2-carboxamide (PubChem CID 114673379) has the molecular formula C14H12BrFN2O2 and a molecular weight of 339.16 g/mol. Its IUPAC name is 4-(5-bromo-2-fluorophenoxy)-N-ethylpyridine-2-carboxamide.

Molecular Properties

Compound Name4-(5-bromo-2-fluorophenoxy)-N-ethylpyridine-2-carboxamide
PubChem CID114673379
Molecular FormulaC14H12BrFN2O2
Molecular Weight339.16 g/mol
Exact Mass338.01
IUPAC Name4-(5-bromo-2-fluorophenoxy)-N-ethylpyridine-2-carboxamide
SMILESCCNC(=O)c1cc(Oc2cc(Br)ccc2F)ccn1
InChIInChI=1S/C14H12BrFN2O2/c1-2-17-14(19)12-8-10(5-6-18-12)20-13-7-9(15)3-4-11(13)16/h3-8H,2H2,1H3,(H,17,19)
InChIKeyYCRPXIUJTZGFTM-UHFFFAOYSA-N
XLogP3.53
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.16
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-(5-bromo-2-fluorophenoxy)-N-ethylpyridine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-(5-bromo-2-methylphenoxy)-N-ethylpyridine-2-carboxamide
CID 107284547
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
methyl 4-(2-amino-4-bromophenoxy)pyridine-2-carboxylate
CID 66287690
4-(5-bromo-2-fluorophenoxy)-N-ethylpyrimidin-2-amine
CID 114677310
N-[[5-(5-bromo-2-fluorophenoxy)-3-pyridinyl]methyl]ethanamine
CID 114674259
N-[[4-bromo-2-(5-bromo-2-fluorophenoxy)phenyl]methyl]ethanamine
CID 114674405
4-[4-[[(2,4-dihydroxybenzoyl)amino]carbamoyl]phenoxy]-N-ethylpyridine-2-carboxamide
CID 143062051
4-(5-bromo-2,3-difluorophenoxy)-N-ethylpyridin-2-amine
CID 107102586
4-bromo-N-dodecylpyridine-2-carboxamide
CID 132587561

Frequently Asked Questions

What is the IUPAC name of 4-(5-bromo-2-fluorophenoxy)-N-ethylpyridine-2-carboxamide?
The IUPAC name of 4-(5-bromo-2-fluorophenoxy)-N-ethylpyridine-2-carboxamide (CID 114673379) is 4-(5-bromo-2-fluorophenoxy)-N-ethylpyridine-2-carboxamide.
What is the SMILES notation for 4-(5-bromo-2-fluorophenoxy)-N-ethylpyridine-2-carboxamide?
The canonical SMILES for 4-(5-bromo-2-fluorophenoxy)-N-ethylpyridine-2-carboxamide is CCNC(=O)c1cc(Oc2cc(Br)ccc2F)ccn1.
What is the InChIKey of 4-(5-bromo-2-fluorophenoxy)-N-ethylpyridine-2-carboxamide?
The InChIKey is YCRPXIUJTZGFTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12BrFN2O2/c1-2-17-14(19)12-8-10(5-6-18-12)20-13-7-9(15)3-4-11(13)16/h3-8H,2H2,1H3,(H,17,19).
What are the key properties of 4-(5-bromo-2-fluorophenoxy)-N-ethylpyridine-2-carboxamide?
4-(5-bromo-2-fluorophenoxy)-N-ethylpyridine-2-carboxamide has a molecular weight of 339.16 g/mol, XLogP of 3.53, 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-fluorophenoxy)-N-ethylpyridine-2-carboxamide is sourced from PubChem (CID 114673379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).