2-(4-fluorophenoxy)-N-propan-2-ylpyridine-3-carboxamide

C15H15FN2O2 — CID 14555280

IUPAC2-(4-fluorophenoxy)-N-propan-2-ylpyridine-3-carboxamide
SMILESCC(C)NC(=O)c1cccnc1Oc1ccc(F)cc1
InChIInChI=1S/C15H15FN2O2/c1-10(2)18-14(19)13-4-3-9-17-15(13)20-12-7-5-11(16)6-8-12/h3-10H,1-2H3,(H,18,19)
InChIKeyJAFMQAZQUFBGLB-UHFFFAOYSA-N
MW274.30 g/mol
LogP3.15
Rot. Bonds4

About 2-(4-fluorophenoxy)-N-propan-2-ylpyridine-3-carboxamide

2-(4-fluorophenoxy)-N-propan-2-ylpyridine-3-carboxamide (PubChem CID 14555280) has the molecular formula C15H15FN2O2 and a molecular weight of 274.30 g/mol. Its IUPAC name is 2-(4-fluorophenoxy)-N-propan-2-ylpyridine-3-carboxamide.

Molecular Properties

Compound Name2-(4-fluorophenoxy)-N-propan-2-ylpyridine-3-carboxamide
PubChem CID14555280
Molecular FormulaC15H15FN2O2
Molecular Weight274.30 g/mol
Exact Mass274.11
IUPAC Name2-(4-fluorophenoxy)-N-propan-2-ylpyridine-3-carboxamide
SMILESCC(C)NC(=O)c1cccnc1Oc1ccc(F)cc1
InChIInChI=1S/C15H15FN2O2/c1-10(2)18-14(19)13-4-3-9-17-15(13)20-12-7-5-11(16)6-8-12/h3-10H,1-2H3,(H,18,19)
InChIKeyJAFMQAZQUFBGLB-UHFFFAOYSA-N
XLogP3.15
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.30
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenoxy)-N-propan-2-ylpyridine-3-carboxamide?
The IUPAC name of 2-(4-fluorophenoxy)-N-propan-2-ylpyridine-3-carboxamide (CID 14555280) is 2-(4-fluorophenoxy)-N-propan-2-ylpyridine-3-carboxamide.
What is the SMILES notation for 2-(4-fluorophenoxy)-N-propan-2-ylpyridine-3-carboxamide?
The canonical SMILES for 2-(4-fluorophenoxy)-N-propan-2-ylpyridine-3-carboxamide is CC(C)NC(=O)c1cccnc1Oc1ccc(F)cc1.
What is the InChIKey of 2-(4-fluorophenoxy)-N-propan-2-ylpyridine-3-carboxamide?
The InChIKey is JAFMQAZQUFBGLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15FN2O2/c1-10(2)18-14(19)13-4-3-9-17-15(13)20-12-7-5-11(16)6-8-12/h3-10H,1-2H3,(H,18,19).
What are the key properties of 2-(4-fluorophenoxy)-N-propan-2-ylpyridine-3-carboxamide?
2-(4-fluorophenoxy)-N-propan-2-ylpyridine-3-carboxamide has a molecular weight of 274.30 g/mol, XLogP of 3.15, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenoxy)-N-propan-2-ylpyridine-3-carboxamide is sourced from PubChem (CID 14555280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).