2-(2-fluorophenyl)-2-methoxy-N-[(2-methyl-6-oxo-1H-pyridin-4-yl)methyl]propanamide

C17H19FN2O3 — CID 126827499

IUPAC2-(2-fluorophenyl)-2-methoxy-N-[(2-methyl-6-oxo-1H-pyridin-4-yl)methyl]propanamide
SMILESCOC(C)(C(=O)NCc1cc(C)[nH]c(=O)c1)c1ccccc1F
InChIInChI=1S/C17H19FN2O3/c1-11-8-12(9-15(21)20-11)10-19-16(22)17(2,23-3)13-6-4-5-7-14(13)18/h4-9H,10H2,1-3H3,(H,19,22)(H,20,21)
InChIKeySQNGEWOMGVRRQR-UHFFFAOYSA-N
MW318.35 g/mol
LogP2.00
Rot. Bonds5

About 2-(2-fluorophenyl)-2-methoxy-N-[(2-methyl-6-oxo-1H-pyridin-4-yl)methyl]propanamide

2-(2-fluorophenyl)-2-methoxy-N-[(2-methyl-6-oxo-1H-pyridin-4-yl)methyl]propanamide (PubChem CID 126827499) has the molecular formula C17H19FN2O3 and a molecular weight of 318.35 g/mol. Its IUPAC name is 2-(2-fluorophenyl)-2-methoxy-N-[(2-methyl-6-oxo-1H-pyridin-4-yl)methyl]propanamide.

Molecular Properties

Compound Name2-(2-fluorophenyl)-2-methoxy-N-[(2-methyl-6-oxo-1H-pyridin-4-yl)methyl]propanamide
PubChem CID126827499
Molecular FormulaC17H19FN2O3
Molecular Weight318.35 g/mol
Exact Mass318.14
IUPAC Name2-(2-fluorophenyl)-2-methoxy-N-[(2-methyl-6-oxo-1H-pyridin-4-yl)methyl]propanamide
SMILESCOC(C)(C(=O)NCc1cc(C)[nH]c(=O)c1)c1ccccc1F
InChIInChI=1S/C17H19FN2O3/c1-11-8-12(9-15(21)20-11)10-19-16(22)17(2,23-3)13-6-4-5-7-14(13)18/h4-9H,10H2,1-3H3,(H,19,22)(H,20,21)
InChIKeySQNGEWOMGVRRQR-UHFFFAOYSA-N
XLogP2.00
TPSA71.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.35
LogP ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[2-(Cyclohexylamino)-1-(2-fluorophenyl)-2-oxoethyl] acetate
CID 3230480
[2-(Cyclohexylamino)-1-(3-fluorophenyl)-2-oxoethyl] acetate
CID 3230481
N-cyclooctyl-2-methoxy-2-phenylacetamide
CID 2921709
[1-[2-(Cyclohexen-1-yl)ethylamino]-1-oxopropan-2-yl] 2,6-difluorobenzoate
CID 3976873
3-Methoxy-3-phenyl-2-piperidinone
CID 137300
X 100
CID 19153
Acetamide, N-(2-dimethylaminoethyl)-2-ethoxy-N-methyl-2,2-diphenyl-, hydrochloride
CID 47075
N-(2,4-dimethylpentan-3-yl)-2-methoxy-2-phenylacetamide
CID 2897080
2-phenyl-2-(3-phenylpropoxy)-N-(3-phenylpropyl)butanamide
CID 11373377
[2-[2-(Cyclohexen-1-yl)ethylamino]-2-oxoethyl] 3-fluorobenzoate
CID 2413558
Acetamide, N-(2-(dimethylamino)ethyl)-2,2-diphenyl-2-ethoxy-, hydrochloride
CID 29247
Benzilamide, N-ethyl-N-(1-methyl-1,2,3,6-tetrahydro-4-pyridyl)methyl-, hydrochloride
CID 24834801

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenyl)-2-methoxy-N-[(2-methyl-6-oxo-1H-pyridin-4-yl)methyl]propanamide?
The IUPAC name of 2-(2-fluorophenyl)-2-methoxy-N-[(2-methyl-6-oxo-1H-pyridin-4-yl)methyl]propanamide (CID 126827499) is 2-(2-fluorophenyl)-2-methoxy-N-[(2-methyl-6-oxo-1H-pyridin-4-yl)methyl]propanamide.
What is the SMILES notation for 2-(2-fluorophenyl)-2-methoxy-N-[(2-methyl-6-oxo-1H-pyridin-4-yl)methyl]propanamide?
The canonical SMILES for 2-(2-fluorophenyl)-2-methoxy-N-[(2-methyl-6-oxo-1H-pyridin-4-yl)methyl]propanamide is COC(C)(C(=O)NCc1cc(C)[nH]c(=O)c1)c1ccccc1F.
What is the InChIKey of 2-(2-fluorophenyl)-2-methoxy-N-[(2-methyl-6-oxo-1H-pyridin-4-yl)methyl]propanamide?
The InChIKey is SQNGEWOMGVRRQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FN2O3/c1-11-8-12(9-15(21)20-11)10-19-16(22)17(2,23-3)13-6-4-5-7-14(13)18/h4-9H,10H2,1-3H3,(H,19,22)(H,20,21).
What are the key properties of 2-(2-fluorophenyl)-2-methoxy-N-[(2-methyl-6-oxo-1H-pyridin-4-yl)methyl]propanamide?
2-(2-fluorophenyl)-2-methoxy-N-[(2-methyl-6-oxo-1H-pyridin-4-yl)methyl]propanamide has a molecular weight of 318.35 g/mol, XLogP of 2.00, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenyl)-2-methoxy-N-[(2-methyl-6-oxo-1H-pyridin-4-yl)methyl]propanamide is sourced from PubChem (CID 126827499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).