3-fluoro-N-methyl-N-(2-phenoxyethyl)pyridine-4-carboxamide

C15H15FN2O2 — CID 115645434

IUPAC3-fluoro-N-methyl-N-(2-phenoxyethyl)pyridine-4-carboxamide
SMILESCN(CCOc1ccccc1)C(=O)c1ccncc1F
InChIInChI=1S/C15H15FN2O2/c1-18(9-10-20-12-5-3-2-4-6-12)15(19)13-7-8-17-11-14(13)16/h2-8,11H,9-10H2,1H3
InChIKeyUZICVQPZDWEBBX-UHFFFAOYSA-N
MW274.30 g/mol
LogP2.37
Rot. Bonds5

About 3-fluoro-N-methyl-N-(2-phenoxyethyl)pyridine-4-carboxamide

3-fluoro-N-methyl-N-(2-phenoxyethyl)pyridine-4-carboxamide (PubChem CID 115645434) has the molecular formula C15H15FN2O2 and a molecular weight of 274.30 g/mol. Its IUPAC name is 3-fluoro-N-methyl-N-(2-phenoxyethyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name3-fluoro-N-methyl-N-(2-phenoxyethyl)pyridine-4-carboxamide
PubChem CID115645434
Molecular FormulaC15H15FN2O2
Molecular Weight274.30 g/mol
Exact Mass274.11
IUPAC Name3-fluoro-N-methyl-N-(2-phenoxyethyl)pyridine-4-carboxamide
SMILESCN(CCOc1ccccc1)C(=O)c1ccncc1F
InChIInChI=1S/C15H15FN2O2/c1-18(9-10-20-12-5-3-2-4-6-12)15(19)13-7-8-17-11-14(13)16/h2-8,11H,9-10H2,1H3
InChIKeyUZICVQPZDWEBBX-UHFFFAOYSA-N
XLogP2.37
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.30
LogP ≤ 52.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-fluoro-N-methyl-N-(2-pyridin-2-ylethyl)pyridine-4-carboxamide
CID 115646430
3-chloro-N-[2-(4-chlorophenoxy)ethyl]-N-methylpyridine-4-carboxamide
CID 66482556
2-chloro-5-fluoro-N-methyl-N-(2-phenoxyethyl)pyridine-3-carboxamide
CID 103891558
3-fluoro-N-(2-phenoxyethyl)pyridine-4-carboxamide
CID 115645467
N-(2-cyanoethyl)-3-fluoro-N-methylpyridine-4-carboxamide
CID 64949290
3-chloro-N-methyl-N-[2-(3-methylphenoxy)ethyl]pyridine-4-carboxamide
CID 66483737
3-fluoro-N,N-dimethylpyridine-4-carboxamide
CID 64950687
3-fluoro-N-methyl-N-(pyridin-3-ylmethyl)pyridine-4-carboxamide
CID 113240917
5-(4-chlorophenyl)-N-methyl-N-(2-phenoxyethyl)-1H-pyrazole-4-carboxamide
CID 16596269
3-amino-N-methyl-N-(2-phenoxyethyl)pyrazine-2-carboxamide
CID 18136300
N-[2-(2-fluorophenoxy)ethyl]-N-methyl-2-phenoxybenzamide
CID 18282160
4-amino-2-chloro-N-methyl-N-(2-phenoxyethyl)benzamide
CID 61114074

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N-methyl-N-(2-phenoxyethyl)pyridine-4-carboxamide?
The IUPAC name of 3-fluoro-N-methyl-N-(2-phenoxyethyl)pyridine-4-carboxamide (CID 115645434) is 3-fluoro-N-methyl-N-(2-phenoxyethyl)pyridine-4-carboxamide.
What is the SMILES notation for 3-fluoro-N-methyl-N-(2-phenoxyethyl)pyridine-4-carboxamide?
The canonical SMILES for 3-fluoro-N-methyl-N-(2-phenoxyethyl)pyridine-4-carboxamide is CN(CCOc1ccccc1)C(=O)c1ccncc1F.
What is the InChIKey of 3-fluoro-N-methyl-N-(2-phenoxyethyl)pyridine-4-carboxamide?
The InChIKey is UZICVQPZDWEBBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15FN2O2/c1-18(9-10-20-12-5-3-2-4-6-12)15(19)13-7-8-17-11-14(13)16/h2-8,11H,9-10H2,1H3.
What are the key properties of 3-fluoro-N-methyl-N-(2-phenoxyethyl)pyridine-4-carboxamide?
3-fluoro-N-methyl-N-(2-phenoxyethyl)pyridine-4-carboxamide has a molecular weight of 274.30 g/mol, XLogP of 2.37, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N-methyl-N-(2-phenoxyethyl)pyridine-4-carboxamide is sourced from PubChem (CID 115645434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).