N-[5-(3-fluorophenoxy)-2-pyridinyl]-1-methyl-6-oxopyridine-3-carboxamide

C18H14FN3O3 — CID 139521826

IUPACN-[5-(3-fluorophenoxy)-2-pyridinyl]-1-methyl-6-oxopyridine-3-carboxamide
SMILESCn1cc(C(=O)Nc2ccc(Oc3cccc(F)c3)cn2)ccc1=O
InChIInChI=1S/C18H14FN3O3/c1-22-11-12(5-8-17(22)23)18(24)21-16-7-6-15(10-20-16)25-14-4-2-3-13(19)9-14/h2-11H,1H3,(H,20,21,24)
InChIKeyNBSYWUAHTHIBBR-UHFFFAOYSA-N
MW339.33 g/mol
LogP2.96
Rot. Bonds4

About N-[5-(3-fluorophenoxy)-2-pyridinyl]-1-methyl-6-oxopyridine-3-carboxamide

N-[5-(3-fluorophenoxy)-2-pyridinyl]-1-methyl-6-oxopyridine-3-carboxamide (PubChem CID 139521826) has the molecular formula C18H14FN3O3 and a molecular weight of 339.33 g/mol. Its IUPAC name is N-[5-(3-fluorophenoxy)-2-pyridinyl]-1-methyl-6-oxopyridine-3-carboxamide.

Molecular Properties

Compound NameN-[5-(3-fluorophenoxy)-2-pyridinyl]-1-methyl-6-oxopyridine-3-carboxamide
PubChem CID139521826
Molecular FormulaC18H14FN3O3
Molecular Weight339.33 g/mol
Exact Mass339.10
IUPAC NameN-[5-(3-fluorophenoxy)-2-pyridinyl]-1-methyl-6-oxopyridine-3-carboxamide
SMILESCn1cc(C(=O)Nc2ccc(Oc3cccc(F)c3)cn2)ccc1=O
InChIInChI=1S/C18H14FN3O3/c1-22-11-12(5-8-17(22)23)18(24)21-16-7-6-15(10-20-16)25-14-4-2-3-13(19)9-14/h2-11H,1H3,(H,20,21,24)
InChIKeyNBSYWUAHTHIBBR-UHFFFAOYSA-N
XLogP2.96
TPSA73.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.33
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[5-(3-chlorophenoxy)-2-pyridinyl]-1-methyl-6-oxopyridine-3-carboxamide
CID 139521731
N-[5-(3-fluorophenoxy)-2-pyridinyl]-1-methyl-6-oxopyridazine-3-carboxamide
CID 139521777
6-[(3-fluorobenzoyl)amino]pyridine-3-carboxylic acid
CID 61318981
1-methyl-6-oxo-N-[5-(2-phenylcyclopropyl)-2-pyridinyl]pyridine-3-carboxamide
CID 167675958
N-[4-(3-fluorophenoxy)phenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide
CID 60538527
4-tert-butyl-N-[4-(3-fluorophenoxy)phenyl]benzamide
CID 142594929
N-[5-(3-fluoroanilino)-2-pyridinyl]-4-methylbenzamide
CID 113035866
1-[(3-fluorophenyl)methyl]-N-(5-methyl-1,2-oxazol-3-yl)-6-oxopyridine-3-carboxamide
CID 8671117
3-fluoro-N-[5-[2-(4-methoxyphenyl)ethylamino]-2-pyridinyl]benzamide
CID 113028470
N-[5-(3-fluoroanilino)-2-pyridinyl]-3,4-dimethoxybenzamide
CID 113035879
N-(3-acetylphenyl)-1-methyl-6-oxopyridine-3-carboxamide
CID 110693091
N-[4-(3-fluorophenoxy)-2-pyridinyl]acetamide
CID 141205782

Frequently Asked Questions

What is the IUPAC name of N-[5-(3-fluorophenoxy)-2-pyridinyl]-1-methyl-6-oxopyridine-3-carboxamide?
The IUPAC name of N-[5-(3-fluorophenoxy)-2-pyridinyl]-1-methyl-6-oxopyridine-3-carboxamide (CID 139521826) is N-[5-(3-fluorophenoxy)-2-pyridinyl]-1-methyl-6-oxopyridine-3-carboxamide.
What is the SMILES notation for N-[5-(3-fluorophenoxy)-2-pyridinyl]-1-methyl-6-oxopyridine-3-carboxamide?
The canonical SMILES for N-[5-(3-fluorophenoxy)-2-pyridinyl]-1-methyl-6-oxopyridine-3-carboxamide is Cn1cc(C(=O)Nc2ccc(Oc3cccc(F)c3)cn2)ccc1=O.
What is the InChIKey of N-[5-(3-fluorophenoxy)-2-pyridinyl]-1-methyl-6-oxopyridine-3-carboxamide?
The InChIKey is NBSYWUAHTHIBBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14FN3O3/c1-22-11-12(5-8-17(22)23)18(24)21-16-7-6-15(10-20-16)25-14-4-2-3-13(19)9-14/h2-11H,1H3,(H,20,21,24).
What are the key properties of N-[5-(3-fluorophenoxy)-2-pyridinyl]-1-methyl-6-oxopyridine-3-carboxamide?
N-[5-(3-fluorophenoxy)-2-pyridinyl]-1-methyl-6-oxopyridine-3-carboxamide has a molecular weight of 339.33 g/mol, XLogP of 2.96, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(3-fluorophenoxy)-2-pyridinyl]-1-methyl-6-oxopyridine-3-carboxamide is sourced from PubChem (CID 139521826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).