N-(1,4-dimethyl-2-oxo-3-pyridinyl)-2-(4-methylphenoxy)propanamide

C17H20N2O3 — CID 154864064

IUPACN-(1,4-dimethyl-2-oxo-3-pyridinyl)-2-(4-methylphenoxy)propanamide
SMILESCc1ccc(OC(C)C(=O)Nc2c(C)ccn(C)c2=O)cc1
InChIInChI=1S/C17H20N2O3/c1-11-5-7-14(8-6-11)22-13(3)16(20)18-15-12(2)9-10-19(4)17(15)21/h5-10,13H,1-4H3,(H,18,20)
InChIKeyKONPEUHHLDPNMH-UHFFFAOYSA-N
MW300.36 g/mol
LogP2.41
Rot. Bonds4

About N-(1,4-dimethyl-2-oxo-3-pyridinyl)-2-(4-methylphenoxy)propanamide

N-(1,4-dimethyl-2-oxo-3-pyridinyl)-2-(4-methylphenoxy)propanamide (PubChem CID 154864064) has the molecular formula C17H20N2O3 and a molecular weight of 300.36 g/mol. Its IUPAC name is N-(1,4-dimethyl-2-oxo-3-pyridinyl)-2-(4-methylphenoxy)propanamide.

Molecular Properties

Compound NameN-(1,4-dimethyl-2-oxo-3-pyridinyl)-2-(4-methylphenoxy)propanamide
PubChem CID154864064
Molecular FormulaC17H20N2O3
Molecular Weight300.36 g/mol
Exact Mass300.15
IUPAC NameN-(1,4-dimethyl-2-oxo-3-pyridinyl)-2-(4-methylphenoxy)propanamide
SMILESCc1ccc(OC(C)C(=O)Nc2c(C)ccn(C)c2=O)cc1
InChIInChI=1S/C17H20N2O3/c1-11-5-7-14(8-6-11)22-13(3)16(20)18-15-12(2)9-10-19(4)17(15)21/h5-10,13H,1-4H3,(H,18,20)
InChIKeyKONPEUHHLDPNMH-UHFFFAOYSA-N
XLogP2.41
TPSA60.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-2-(4-methylphenoxy)-N-[2-[[(2S)-2-(4-methylphenoxy)propanoyl]amino]phenyl]propanamide
CID 1019889
N-(3,5-dimethylphenyl)-2-(4-methylphenoxy)propanamide
CID 4928504
(2S)-N-(2,6-dimethylphenyl)-2-(4-fluorophenoxy)propanamide
CID 51473397
(2S)-2-(4-fluorophenoxy)-N-(2,4,6-trimethylphenyl)propanamide
CID 26074940
(2S)-2-(4-chlorophenoxy)-N-(2,4,6-trimethylphenyl)propanamide
CID 8760048
(2S)-2-(4-methylphenoxy)-N-[4-(4-methylpiperazin-1-yl)phenyl]propanamide
CID 30857195
2-(4-chlorophenoxy)-N-(4-methylphenyl)propanamide
CID 4943921
2-(3,4-dimethylphenoxy)-N-(4-methylphenyl)propanamide
CID 53266277
2-(4-methylphenoxy)-N-(4-pyrrolidin-1-ylphenyl)propanamide
CID 133166686
N-(4-methylphenyl)-2-phenoxypropanamide
CID 4639701
(2R)-N-(2-hydroxy-4-methylphenyl)-2-(4-methylphenoxy)propanamide
CID 92534084
(2R)-N-(4-methyl-1,3-benzothiazol-2-yl)-2-(4-methylphenoxy)propanamide
CID 837350

Frequently Asked Questions

What is the IUPAC name of N-(1,4-dimethyl-2-oxo-3-pyridinyl)-2-(4-methylphenoxy)propanamide?
The IUPAC name of N-(1,4-dimethyl-2-oxo-3-pyridinyl)-2-(4-methylphenoxy)propanamide (CID 154864064) is N-(1,4-dimethyl-2-oxo-3-pyridinyl)-2-(4-methylphenoxy)propanamide.
What is the SMILES notation for N-(1,4-dimethyl-2-oxo-3-pyridinyl)-2-(4-methylphenoxy)propanamide?
The canonical SMILES for N-(1,4-dimethyl-2-oxo-3-pyridinyl)-2-(4-methylphenoxy)propanamide is Cc1ccc(OC(C)C(=O)Nc2c(C)ccn(C)c2=O)cc1.
What is the InChIKey of N-(1,4-dimethyl-2-oxo-3-pyridinyl)-2-(4-methylphenoxy)propanamide?
The InChIKey is KONPEUHHLDPNMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O3/c1-11-5-7-14(8-6-11)22-13(3)16(20)18-15-12(2)9-10-19(4)17(15)21/h5-10,13H,1-4H3,(H,18,20).
What are the key properties of N-(1,4-dimethyl-2-oxo-3-pyridinyl)-2-(4-methylphenoxy)propanamide?
N-(1,4-dimethyl-2-oxo-3-pyridinyl)-2-(4-methylphenoxy)propanamide has a molecular weight of 300.36 g/mol, XLogP of 2.41, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,4-dimethyl-2-oxo-3-pyridinyl)-2-(4-methylphenoxy)propanamide is sourced from PubChem (CID 154864064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).