N-[4-(3-fluorophenyl)oxan-4-yl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide

C18H19FN2O3 — CID 71993748

IUPACN-[4-(3-fluorophenyl)oxan-4-yl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide
SMILESCc1ccc(C(=O)NC2(c3cccc(F)c3)CCOCC2)c(=O)[nH]1
InChIInChI=1S/C18H19FN2O3/c1-12-5-6-15(16(22)20-12)17(23)21-18(7-9-24-10-8-18)13-3-2-4-14(19)11-13/h2-6,11H,7-10H2,1H3,(H,20,22)(H,21,23)
InChIKeyLOSXPUJQPVCZQE-UHFFFAOYSA-N
MW330.36 g/mol
LogP2.26
Rot. Bonds3

About N-[4-(3-fluorophenyl)oxan-4-yl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide

N-[4-(3-fluorophenyl)oxan-4-yl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide (PubChem CID 71993748) has the molecular formula C18H19FN2O3 and a molecular weight of 330.36 g/mol. Its IUPAC name is N-[4-(3-fluorophenyl)oxan-4-yl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[4-(3-fluorophenyl)oxan-4-yl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide
PubChem CID71993748
Molecular FormulaC18H19FN2O3
Molecular Weight330.36 g/mol
Exact Mass330.14
IUPAC NameN-[4-(3-fluorophenyl)oxan-4-yl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide
SMILESCc1ccc(C(=O)NC2(c3cccc(F)c3)CCOCC2)c(=O)[nH]1
InChIInChI=1S/C18H19FN2O3/c1-12-5-6-15(16(22)20-12)17(23)21-18(7-9-24-10-8-18)13-3-2-4-14(19)11-13/h2-6,11H,7-10H2,1H3,(H,20,22)(H,21,23)
InChIKeyLOSXPUJQPVCZQE-UHFFFAOYSA-N
XLogP2.26
TPSA71.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.36
LogP ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[4-(3-fluorophenyl)oxan-4-yl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-[4-(3-fluorophenyl)oxan-4-yl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide (CID 71993748) is N-[4-(3-fluorophenyl)oxan-4-yl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-[4-(3-fluorophenyl)oxan-4-yl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-[4-(3-fluorophenyl)oxan-4-yl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide is Cc1ccc(C(=O)NC2(c3cccc(F)c3)CCOCC2)c(=O)[nH]1.
What is the InChIKey of N-[4-(3-fluorophenyl)oxan-4-yl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide?
The InChIKey is LOSXPUJQPVCZQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19FN2O3/c1-12-5-6-15(16(22)20-12)17(23)21-18(7-9-24-10-8-18)13-3-2-4-14(19)11-13/h2-6,11H,7-10H2,1H3,(H,20,22)(H,21,23).
What are the key properties of N-[4-(3-fluorophenyl)oxan-4-yl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide?
N-[4-(3-fluorophenyl)oxan-4-yl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide has a molecular weight of 330.36 g/mol, XLogP of 2.26, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(3-fluorophenyl)oxan-4-yl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 71993748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).