N-methyl-4-oxo-N-(2,4,6-trimethylphenyl)pentanamide

C15H21NO2 — CID 115176780

IUPACN-methyl-4-oxo-N-(2,4,6-trimethylphenyl)pentanamide
SMILESCC(=O)CCC(=O)N(C)c1c(C)cc(C)cc1C
InChIInChI=1S/C15H21NO2/c1-10-8-11(2)15(12(3)9-10)16(5)14(18)7-6-13(4)17/h8-9H,6-7H2,1-5H3
InChIKeyFLPNMZXUCMJOON-UHFFFAOYSA-N
MW247.34 g/mol
LogP2.94
Rot. Bonds4

About N-methyl-4-oxo-N-(2,4,6-trimethylphenyl)pentanamide

N-methyl-4-oxo-N-(2,4,6-trimethylphenyl)pentanamide (PubChem CID 115176780) has the molecular formula C15H21NO2 and a molecular weight of 247.34 g/mol. Its IUPAC name is N-methyl-4-oxo-N-(2,4,6-trimethylphenyl)pentanamide.

Molecular Properties

Compound NameN-methyl-4-oxo-N-(2,4,6-trimethylphenyl)pentanamide
PubChem CID115176780
Molecular FormulaC15H21NO2
Molecular Weight247.34 g/mol
Exact Mass247.16
IUPAC NameN-methyl-4-oxo-N-(2,4,6-trimethylphenyl)pentanamide
SMILESCC(=O)CCC(=O)N(C)c1c(C)cc(C)cc1C
InChIInChI=1S/C15H21NO2/c1-10-8-11(2)15(12(3)9-10)16(5)14(18)7-6-13(4)17/h8-9H,6-7H2,1-5H3
InChIKeyFLPNMZXUCMJOON-UHFFFAOYSA-N
XLogP2.94
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 52.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-chloro-N-methyl-N-(2,4,6-trimethylphenyl)acetamide
CID 82080926
N-(4-methoxy-3,5-dimethylphenyl)-N-methyl-4-oxopentanamide
CID 115176827
1,3-dimethyl-1,3-bis(2,4,6-trimethylphenyl)guanidine
CID 177044470
4-amino-N,3-dimethyl-N-(2,4,6-trimethylphenyl)butanamide
CID 115156292
N-methyl-N-(2-methyl-5-propan-2-ylphenyl)-4-oxopentanamide
CID 115176806
4-hydroxy-N-(2-methoxy-4,6-dimethylphenyl)-N-methylbutanamide
CID 115162917
3-chloro-N-methyl-N-(2,3,5,6-tetramethylphenyl)propanamide
CID 115162405
2,2-dimethyl-3-oxo-3-(N,2,4,6-tetramethylanilino)propanoic acid
CID 115163983
N-(2,4-dimethylphenyl)-3-hydroxy-N-methylpropanamide
CID 115138834
N-methyl-4-oxo-N-(1H-pyrrol-2-yl)pentanamide
CID 115176799
N-(2-methoxy-4,6-dimethylphenyl)-N-methyl-2-(methylamino)acetamide
CID 82496838
N-(2,6-dimethylphenyl)-2-hydroxy-N-methylacetamide
CID 70578533

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-oxo-N-(2,4,6-trimethylphenyl)pentanamide?
The IUPAC name of N-methyl-4-oxo-N-(2,4,6-trimethylphenyl)pentanamide (CID 115176780) is N-methyl-4-oxo-N-(2,4,6-trimethylphenyl)pentanamide.
What is the SMILES notation for N-methyl-4-oxo-N-(2,4,6-trimethylphenyl)pentanamide?
The canonical SMILES for N-methyl-4-oxo-N-(2,4,6-trimethylphenyl)pentanamide is CC(=O)CCC(=O)N(C)c1c(C)cc(C)cc1C.
What is the InChIKey of N-methyl-4-oxo-N-(2,4,6-trimethylphenyl)pentanamide?
The InChIKey is FLPNMZXUCMJOON-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO2/c1-10-8-11(2)15(12(3)9-10)16(5)14(18)7-6-13(4)17/h8-9H,6-7H2,1-5H3.
What are the key properties of N-methyl-4-oxo-N-(2,4,6-trimethylphenyl)pentanamide?
N-methyl-4-oxo-N-(2,4,6-trimethylphenyl)pentanamide has a molecular weight of 247.34 g/mol, XLogP of 2.94, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-oxo-N-(2,4,6-trimethylphenyl)pentanamide is sourced from PubChem (CID 115176780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).