N-[6-(3-fluorophenoxy)-3-pyridinyl]-6-methyl-4-oxo-1H-pyridine-3-carboxamide

C18H14FN3O3 — CID 75375551

IUPACN-[6-(3-fluorophenoxy)-3-pyridinyl]-6-methyl-4-oxo-1H-pyridine-3-carboxamide
SMILESCc1cc(=O)c(C(=O)Nc2ccc(Oc3cccc(F)c3)nc2)c[nH]1
InChIInChI=1S/C18H14FN3O3/c1-11-7-16(23)15(10-20-11)18(24)22-13-5-6-17(21-9-13)25-14-4-2-3-12(19)8-14/h2-10H,1H3,(H,20,23)(H,22,24)
InChIKeyVREVAAZCYSEETA-UHFFFAOYSA-N
MW339.33 g/mol
LogP3.26
Rot. Bonds4

About N-[6-(3-fluorophenoxy)-3-pyridinyl]-6-methyl-4-oxo-1H-pyridine-3-carboxamide

N-[6-(3-fluorophenoxy)-3-pyridinyl]-6-methyl-4-oxo-1H-pyridine-3-carboxamide (PubChem CID 75375551) has the molecular formula C18H14FN3O3 and a molecular weight of 339.33 g/mol. Its IUPAC name is N-[6-(3-fluorophenoxy)-3-pyridinyl]-6-methyl-4-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[6-(3-fluorophenoxy)-3-pyridinyl]-6-methyl-4-oxo-1H-pyridine-3-carboxamide
PubChem CID75375551
Molecular FormulaC18H14FN3O3
Molecular Weight339.33 g/mol
Exact Mass339.10
IUPAC NameN-[6-(3-fluorophenoxy)-3-pyridinyl]-6-methyl-4-oxo-1H-pyridine-3-carboxamide
SMILESCc1cc(=O)c(C(=O)Nc2ccc(Oc3cccc(F)c3)nc2)c[nH]1
InChIInChI=1S/C18H14FN3O3/c1-11-7-16(23)15(10-20-11)18(24)22-13-5-6-17(21-9-13)25-14-4-2-3-12(19)8-14/h2-10H,1H3,(H,20,23)(H,22,24)
InChIKeyVREVAAZCYSEETA-UHFFFAOYSA-N
XLogP3.26
TPSA84.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.33
LogP ≤ 53.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[6-(3-fluorophenoxy)-3-pyridinyl]-6-methyl-4-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-[6-(3-fluorophenoxy)-3-pyridinyl]-6-methyl-4-oxo-1H-pyridine-3-carboxamide (CID 75375551) is N-[6-(3-fluorophenoxy)-3-pyridinyl]-6-methyl-4-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-[6-(3-fluorophenoxy)-3-pyridinyl]-6-methyl-4-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-[6-(3-fluorophenoxy)-3-pyridinyl]-6-methyl-4-oxo-1H-pyridine-3-carboxamide is Cc1cc(=O)c(C(=O)Nc2ccc(Oc3cccc(F)c3)nc2)c[nH]1.
What is the InChIKey of N-[6-(3-fluorophenoxy)-3-pyridinyl]-6-methyl-4-oxo-1H-pyridine-3-carboxamide?
The InChIKey is VREVAAZCYSEETA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14FN3O3/c1-11-7-16(23)15(10-20-11)18(24)22-13-5-6-17(21-9-13)25-14-4-2-3-12(19)8-14/h2-10H,1H3,(H,20,23)(H,22,24).
What are the key properties of N-[6-(3-fluorophenoxy)-3-pyridinyl]-6-methyl-4-oxo-1H-pyridine-3-carboxamide?
N-[6-(3-fluorophenoxy)-3-pyridinyl]-6-methyl-4-oxo-1H-pyridine-3-carboxamide has a molecular weight of 339.33 g/mol, XLogP of 3.26, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(3-fluorophenoxy)-3-pyridinyl]-6-methyl-4-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 75375551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).