5-fluoro-6-(4-pentylphenoxy)pyridine-3-carboxamide

C17H19FN2O2 — CID 146305871

IUPAC5-fluoro-6-(4-pentylphenoxy)pyridine-3-carboxamide
SMILESCCCCCc1ccc(Oc2ncc(C(N)=O)cc2F)cc1
InChIInChI=1S/C17H19FN2O2/c1-2-3-4-5-12-6-8-14(9-7-12)22-17-15(18)10-13(11-20-17)16(19)21/h6-11H,2-5H2,1H3,(H2,19,21)
InChIKeyAOMVTNGIBYVXRA-UHFFFAOYSA-N
MW302.35 g/mol
LogP3.84
Rot. Bonds7

About 5-fluoro-6-(4-pentylphenoxy)pyridine-3-carboxamide

5-fluoro-6-(4-pentylphenoxy)pyridine-3-carboxamide (PubChem CID 146305871) has the molecular formula C17H19FN2O2 and a molecular weight of 302.35 g/mol. Its IUPAC name is 5-fluoro-6-(4-pentylphenoxy)pyridine-3-carboxamide.

Molecular Properties

Compound Name5-fluoro-6-(4-pentylphenoxy)pyridine-3-carboxamide
PubChem CID146305871
Molecular FormulaC17H19FN2O2
Molecular Weight302.35 g/mol
Exact Mass302.14
IUPAC Name5-fluoro-6-(4-pentylphenoxy)pyridine-3-carboxamide
SMILESCCCCCc1ccc(Oc2ncc(C(N)=O)cc2F)cc1
InChIInChI=1S/C17H19FN2O2/c1-2-3-4-5-12-6-8-14(9-7-12)22-17-15(18)10-13(11-20-17)16(19)21/h6-11H,2-5H2,1H3,(H2,19,21)
InChIKeyAOMVTNGIBYVXRA-UHFFFAOYSA-N
XLogP3.84
TPSA65.21 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.35
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 5-fluoro-6-(4-pentylphenoxy)pyridine-3-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

5-fluoro-6-(4-hexylphenoxy)pyridine-3-carboxylic acid
CID 146305775
3-fluoro-5-methyl-2-(4-pentylphenoxy)pyridine;formamide
CID 142415178
3-fluoro-4-(4-hexylphenoxy)benzamide
CID 142415242
6-(4-pentylphenoxy)pyridine-3-carboxamide
CID 142415252
6-(4-cyclopropylphenoxy)-5-fluoropyridine-3-carboxamide
CID 146305985
3-hydroxy-4-(4-pentylphenoxy)benzamide
CID 166015390
4-octylbenzamide;hydrochloride
CID 131740255
1-[5-fluoro-6-(4-propan-2-ylphenoxy)-3-pyridinyl]propan-1-one
CID 158615225
6-(4-butylphenoxy)-5-methylpyridin-3-amine
CID 115492232
bis[4-(4-hexylphenoxy)phenyl]methanone
CID 139804555
N-hydroxy-6-(4-pentylphenoxy)pyridine-3-carboxamide
CID 142415304
2-(4-nonylphenoxy)acetamide
CID 54388059

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-6-(4-pentylphenoxy)pyridine-3-carboxamide?
The IUPAC name of 5-fluoro-6-(4-pentylphenoxy)pyridine-3-carboxamide (CID 146305871) is 5-fluoro-6-(4-pentylphenoxy)pyridine-3-carboxamide.
What is the SMILES notation for 5-fluoro-6-(4-pentylphenoxy)pyridine-3-carboxamide?
The canonical SMILES for 5-fluoro-6-(4-pentylphenoxy)pyridine-3-carboxamide is CCCCCc1ccc(Oc2ncc(C(N)=O)cc2F)cc1.
What is the InChIKey of 5-fluoro-6-(4-pentylphenoxy)pyridine-3-carboxamide?
The InChIKey is AOMVTNGIBYVXRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FN2O2/c1-2-3-4-5-12-6-8-14(9-7-12)22-17-15(18)10-13(11-20-17)16(19)21/h6-11H,2-5H2,1H3,(H2,19,21).
What are the key properties of 5-fluoro-6-(4-pentylphenoxy)pyridine-3-carboxamide?
5-fluoro-6-(4-pentylphenoxy)pyridine-3-carboxamide has a molecular weight of 302.35 g/mol, XLogP of 3.84, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-6-(4-pentylphenoxy)pyridine-3-carboxamide is sourced from PubChem (CID 146305871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).