N-[1-[(2-chloro-6-fluorophenyl)methyl]-5-methyl-2-oxo-3-pyridinyl]-2-methoxyacetamide

C16H16ClFN2O3 — CID 6488653

IUPACN-[1-[(2-chloro-6-fluorophenyl)methyl]-5-methyl-2-oxo-3-pyridinyl]-2-methoxyacetamide
SMILESCOCC(=O)Nc1cc(C)cn(Cc2c(F)cccc2Cl)c1=O
InChIInChI=1S/C16H16ClFN2O3/c1-10-6-14(19-15(21)9-23-2)16(22)20(7-10)8-11-12(17)4-3-5-13(11)18/h3-7H,8-9H2,1-2H3,(H,19,21)
InChIKeySKENCUQRTFADKU-UHFFFAOYSA-N
MW338.77 g/mol
LogP2.58
Rot. Bonds5

About N-[1-[(2-chloro-6-fluorophenyl)methyl]-5-methyl-2-oxo-3-pyridinyl]-2-methoxyacetamide

N-[1-[(2-chloro-6-fluorophenyl)methyl]-5-methyl-2-oxo-3-pyridinyl]-2-methoxyacetamide (PubChem CID 6488653) has the molecular formula C16H16ClFN2O3 and a molecular weight of 338.77 g/mol. Its IUPAC name is N-[1-[(2-chloro-6-fluorophenyl)methyl]-5-methyl-2-oxo-3-pyridinyl]-2-methoxyacetamide.

Molecular Properties

Compound NameN-[1-[(2-chloro-6-fluorophenyl)methyl]-5-methyl-2-oxo-3-pyridinyl]-2-methoxyacetamide
PubChem CID6488653
Molecular FormulaC16H16ClFN2O3
Molecular Weight338.77 g/mol
Exact Mass338.08
IUPAC NameN-[1-[(2-chloro-6-fluorophenyl)methyl]-5-methyl-2-oxo-3-pyridinyl]-2-methoxyacetamide
SMILESCOCC(=O)Nc1cc(C)cn(Cc2c(F)cccc2Cl)c1=O
InChIInChI=1S/C16H16ClFN2O3/c1-10-6-14(19-15(21)9-23-2)16(22)20(7-10)8-11-12(17)4-3-5-13(11)18/h3-7H,8-9H2,1-2H3,(H,19,21)
InChIKeySKENCUQRTFADKU-UHFFFAOYSA-N
XLogP2.58
TPSA60.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.77
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-[(4-fluorophenyl)methyl]-5-methyl-2-oxo-3-pyridinyl]-2-methoxyacetamide
CID 6488633
2-methoxy-N-[5-methyl-2-oxo-1-[[3-(trifluoromethyl)phenyl]methyl]-3-pyridinyl]acetamide
CID 6488675
2-(2-chloro-6-fluorophenyl)-N-[4-[(2-methoxyacetyl)amino]phenyl]acetamide
CID 35332134
N-(2-chloro-5-methylphenyl)-2-methoxyacetamide
CID 103769395
1-[(2-chloro-6-fluorophenyl)methyl]-4-(3,5-dimethylphenyl)pyrazine-2,3-dione
CID 22520406
N-(2,4-dichlorophenyl)-2-methoxyacetamide
CID 885676
1-[(2-chloro-6-fluorophenyl)methyl]-N-(3-chloro-4-methylphenyl)-2-oxopyridine-3-carboxamide
CID 7598223
N-(4-amino-2-methylphenyl)-2-(2-chloro-6-fluorophenyl)acetamide
CID 28933939
N-[(1R)-1-[1-[(2-chloro-6-fluorophenyl)methyl]benzimidazol-2-yl]ethyl]-2-methoxyacetamide
CID 34958984
[2-(2-methyl-5-nitroanilino)-2-oxoethyl] 2-(2-chloro-6-fluorophenyl)acetate
CID 7718199
N-(5-amino-4-chloro-2-fluorophenyl)-2-methoxyacetamide
CID 22732316
1-[(2-chloro-6-fluorophenyl)methyl]-N-(2-ethylphenyl)-6-oxopyridine-3-carboxamide
CID 26843899

Frequently Asked Questions

What is the IUPAC name of N-[1-[(2-chloro-6-fluorophenyl)methyl]-5-methyl-2-oxo-3-pyridinyl]-2-methoxyacetamide?
The IUPAC name of N-[1-[(2-chloro-6-fluorophenyl)methyl]-5-methyl-2-oxo-3-pyridinyl]-2-methoxyacetamide (CID 6488653) is N-[1-[(2-chloro-6-fluorophenyl)methyl]-5-methyl-2-oxo-3-pyridinyl]-2-methoxyacetamide.
What is the SMILES notation for N-[1-[(2-chloro-6-fluorophenyl)methyl]-5-methyl-2-oxo-3-pyridinyl]-2-methoxyacetamide?
The canonical SMILES for N-[1-[(2-chloro-6-fluorophenyl)methyl]-5-methyl-2-oxo-3-pyridinyl]-2-methoxyacetamide is COCC(=O)Nc1cc(C)cn(Cc2c(F)cccc2Cl)c1=O.
What is the InChIKey of N-[1-[(2-chloro-6-fluorophenyl)methyl]-5-methyl-2-oxo-3-pyridinyl]-2-methoxyacetamide?
The InChIKey is SKENCUQRTFADKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16ClFN2O3/c1-10-6-14(19-15(21)9-23-2)16(22)20(7-10)8-11-12(17)4-3-5-13(11)18/h3-7H,8-9H2,1-2H3,(H,19,21).
What are the key properties of N-[1-[(2-chloro-6-fluorophenyl)methyl]-5-methyl-2-oxo-3-pyridinyl]-2-methoxyacetamide?
N-[1-[(2-chloro-6-fluorophenyl)methyl]-5-methyl-2-oxo-3-pyridinyl]-2-methoxyacetamide has a molecular weight of 338.77 g/mol, XLogP of 2.58, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[(2-chloro-6-fluorophenyl)methyl]-5-methyl-2-oxo-3-pyridinyl]-2-methoxyacetamide is sourced from PubChem (CID 6488653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).