2-(3-cyano-4-methyl-2-oxo-1-pyridinyl)-N-[2-(difluoromethoxy)phenyl]acetamide

C16H13F2N3O3 — CID 75505848

IUPAC2-(3-cyano-4-methyl-2-oxo-1-pyridinyl)-N-[2-(difluoromethoxy)phenyl]acetamide
SMILESCc1ccn(CC(=O)Nc2ccccc2OC(F)F)c(=O)c1C#N
InChIInChI=1S/C16H13F2N3O3/c1-10-6-7-21(15(23)11(10)8-19)9-14(22)20-12-4-2-3-5-13(12)24-16(17)18/h2-7,16H,9H2,1H3,(H,20,22)
InChIKeyRNCJAYMCPDXITM-UHFFFAOYSA-N
MW333.29 g/mol
LogP2.27
Rot. Bonds5

About 2-(3-cyano-4-methyl-2-oxo-1-pyridinyl)-N-[2-(difluoromethoxy)phenyl]acetamide

2-(3-cyano-4-methyl-2-oxo-1-pyridinyl)-N-[2-(difluoromethoxy)phenyl]acetamide (PubChem CID 75505848) has the molecular formula C16H13F2N3O3 and a molecular weight of 333.29 g/mol. Its IUPAC name is 2-(3-cyano-4-methyl-2-oxo-1-pyridinyl)-N-[2-(difluoromethoxy)phenyl]acetamide.

Molecular Properties

Compound Name2-(3-cyano-4-methyl-2-oxo-1-pyridinyl)-N-[2-(difluoromethoxy)phenyl]acetamide
PubChem CID75505848
Molecular FormulaC16H13F2N3O3
Molecular Weight333.29 g/mol
Exact Mass333.09
IUPAC Name2-(3-cyano-4-methyl-2-oxo-1-pyridinyl)-N-[2-(difluoromethoxy)phenyl]acetamide
SMILESCc1ccn(CC(=O)Nc2ccccc2OC(F)F)c(=O)c1C#N
InChIInChI=1S/C16H13F2N3O3/c1-10-6-7-21(15(23)11(10)8-19)9-14(22)20-12-4-2-3-5-13(12)24-16(17)18/h2-7,16H,9H2,1H3,(H,20,22)
InChIKeyRNCJAYMCPDXITM-UHFFFAOYSA-N
XLogP2.27
TPSA84.12 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.29
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(3-cyano-4,6-dimethyl-2-oxo-1-pyridinyl)-N-[2-(difluoromethoxy)phenyl]acetamide
CID 86207797
2-(3-cyano-4-methyl-2-oxo-1-pyridinyl)-N-(2-prop-2-enylsulfanylphenyl)acetamide
CID 86795250
N-[2-(difluoromethoxy)phenyl]-2-(3-nitro-2-oxo-1-pyridinyl)acetamide
CID 47091849
N-[2-(difluoromethoxy)phenyl]-2-pyrazol-1-ylacetamide
CID 39723759
N-[2-(difluoromethoxy)phenyl]-2-(4-methylphenyl)sulfanylacetamide
CID 2995782
N-[2-(difluoromethoxy)phenyl]-2-(2-fluorophenyl)sulfanylacetamide
CID 2591520
1-[2-(2-methoxyanilino)-2-oxoethyl]-3-methylpyrrole-2-carboxylic acid
CID 102604500
2-(3-cyano-4-methyl-2-oxo-1-pyridinyl)-N-[(3-methoxyphenyl)methyl]acetamide
CID 75430569
N-[2-(difluoromethoxy)phenyl]-2-(4-fluorophenyl)sulfanylacetamide
CID 2994410
N-[2-(difluoromethoxy)phenyl]-2-(2-ethoxyanilino)acetamide
CID 9102233
2-[4-[2-(butan-2-ylamino)-2-oxoethyl]piperazin-1-yl]-N-[2-(difluoromethoxy)phenyl]acetamide
CID 55565889
2-[4-(4-cyanophenyl)phenoxy]-N-[2-(difluoromethoxy)phenyl]acetamide
CID 7670294

Frequently Asked Questions

What is the IUPAC name of 2-(3-cyano-4-methyl-2-oxo-1-pyridinyl)-N-[2-(difluoromethoxy)phenyl]acetamide?
The IUPAC name of 2-(3-cyano-4-methyl-2-oxo-1-pyridinyl)-N-[2-(difluoromethoxy)phenyl]acetamide (CID 75505848) is 2-(3-cyano-4-methyl-2-oxo-1-pyridinyl)-N-[2-(difluoromethoxy)phenyl]acetamide.
What is the SMILES notation for 2-(3-cyano-4-methyl-2-oxo-1-pyridinyl)-N-[2-(difluoromethoxy)phenyl]acetamide?
The canonical SMILES for 2-(3-cyano-4-methyl-2-oxo-1-pyridinyl)-N-[2-(difluoromethoxy)phenyl]acetamide is Cc1ccn(CC(=O)Nc2ccccc2OC(F)F)c(=O)c1C#N.
What is the InChIKey of 2-(3-cyano-4-methyl-2-oxo-1-pyridinyl)-N-[2-(difluoromethoxy)phenyl]acetamide?
The InChIKey is RNCJAYMCPDXITM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13F2N3O3/c1-10-6-7-21(15(23)11(10)8-19)9-14(22)20-12-4-2-3-5-13(12)24-16(17)18/h2-7,16H,9H2,1H3,(H,20,22).
What are the key properties of 2-(3-cyano-4-methyl-2-oxo-1-pyridinyl)-N-[2-(difluoromethoxy)phenyl]acetamide?
2-(3-cyano-4-methyl-2-oxo-1-pyridinyl)-N-[2-(difluoromethoxy)phenyl]acetamide has a molecular weight of 333.29 g/mol, XLogP of 2.27, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-cyano-4-methyl-2-oxo-1-pyridinyl)-N-[2-(difluoromethoxy)phenyl]acetamide is sourced from PubChem (CID 75505848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).