N-(2-fluorophenyl)-4-oxo-5-phenylmethoxypyran-2-carboxamide

C19H14FNO4 — CID 45494955

IUPACN-(2-fluorophenyl)-4-oxo-5-phenylmethoxypyran-2-carboxamide
SMILESO=C(Nc1ccccc1F)c1cc(=O)c(OCc2ccccc2)co1
InChIInChI=1S/C19H14FNO4/c20-14-8-4-5-9-15(14)21-19(23)17-10-16(22)18(12-25-17)24-11-13-6-2-1-3-7-13/h1-10,12H,11H2,(H,21,23)
InChIKeyPDMVKXPUUUJEBU-UHFFFAOYSA-N
MW339.32 g/mol
LogP3.61
Rot. Bonds5

About N-(2-fluorophenyl)-4-oxo-5-phenylmethoxypyran-2-carboxamide

N-(2-fluorophenyl)-4-oxo-5-phenylmethoxypyran-2-carboxamide (PubChem CID 45494955) has the molecular formula C19H14FNO4 and a molecular weight of 339.32 g/mol. Its IUPAC name is N-(2-fluorophenyl)-4-oxo-5-phenylmethoxypyran-2-carboxamide.

Molecular Properties

Compound NameN-(2-fluorophenyl)-4-oxo-5-phenylmethoxypyran-2-carboxamide
PubChem CID45494955
Molecular FormulaC19H14FNO4
Molecular Weight339.32 g/mol
Exact Mass339.09
IUPAC NameN-(2-fluorophenyl)-4-oxo-5-phenylmethoxypyran-2-carboxamide
SMILESO=C(Nc1ccccc1F)c1cc(=O)c(OCc2ccccc2)co1
InChIInChI=1S/C19H14FNO4/c20-14-8-4-5-9-15(14)21-19(23)17-10-16(22)18(12-25-17)24-11-13-6-2-1-3-7-13/h1-10,12H,11H2,(H,21,23)
InChIKeyPDMVKXPUUUJEBU-UHFFFAOYSA-N
XLogP3.61
TPSA68.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.32
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-carbamoylphenyl)-4-oxo-5-phenylmethoxypyran-2-carboxamide
CID 42227017
5-[(2-fluorophenyl)methoxy]-4-oxo-N-phenylpyran-2-carboxamide
CID 86206858
N-(4-fluorophenyl)-5-[(4-fluorophenyl)methoxy]-4-oxopyran-2-carboxamide
CID 42227224
4-oxo-5-phenylmethoxy-N-(3,4,5-trimethoxyphenyl)pyran-2-carboxamide
CID 42227009
5-[(4-fluorophenyl)methoxy]-4-oxo-N-[(1S)-1-phenylethyl]pyran-2-carboxamide
CID 42227199
N-[(3-chlorophenyl)methyl]-4-oxo-5-phenylmethoxypyran-2-carboxamide
CID 45490762
5-[(5-chloro-2-phenylmethoxyphenyl)methyl]-N-(2-fluorophenyl)furan-2-carboxamide
CID 15605179
N-(2-fluorophenyl)-2-[(4-fluorophenyl)methoxy]benzamide
CID 26115053
methyl 4-[[5-[(4-fluorophenyl)methoxy]-4-oxopyran-2-carbonyl]amino]benzoate
CID 42227239
2-(azepane-1-carbonyl)-5-phenylmethoxypyran-4-one
CID 42226882
N-(6-methyl-1,3-benzothiazol-2-yl)-4-oxo-5-phenylmethoxypyran-2-carboxamide
CID 42226983
N-(1-benzylpiperidin-4-yl)-4-oxo-5-phenylmethoxypyran-2-carboxamide
CID 42227002

Frequently Asked Questions

What is the IUPAC name of N-(2-fluorophenyl)-4-oxo-5-phenylmethoxypyran-2-carboxamide?
The IUPAC name of N-(2-fluorophenyl)-4-oxo-5-phenylmethoxypyran-2-carboxamide (CID 45494955) is N-(2-fluorophenyl)-4-oxo-5-phenylmethoxypyran-2-carboxamide.
What is the SMILES notation for N-(2-fluorophenyl)-4-oxo-5-phenylmethoxypyran-2-carboxamide?
The canonical SMILES for N-(2-fluorophenyl)-4-oxo-5-phenylmethoxypyran-2-carboxamide is O=C(Nc1ccccc1F)c1cc(=O)c(OCc2ccccc2)co1.
What is the InChIKey of N-(2-fluorophenyl)-4-oxo-5-phenylmethoxypyran-2-carboxamide?
The InChIKey is PDMVKXPUUUJEBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14FNO4/c20-14-8-4-5-9-15(14)21-19(23)17-10-16(22)18(12-25-17)24-11-13-6-2-1-3-7-13/h1-10,12H,11H2,(H,21,23).
What are the key properties of N-(2-fluorophenyl)-4-oxo-5-phenylmethoxypyran-2-carboxamide?
N-(2-fluorophenyl)-4-oxo-5-phenylmethoxypyran-2-carboxamide has a molecular weight of 339.32 g/mol, XLogP of 3.61, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluorophenyl)-4-oxo-5-phenylmethoxypyran-2-carboxamide is sourced from PubChem (CID 45494955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).