2,2-dimethyl-N-[2-oxo-2-(2,4,6-trimethylphenyl)ethyl]propanamide

C16H23NO2 — CID 82121737

IUPAC2,2-dimethyl-N-[2-oxo-2-(2,4,6-trimethylphenyl)ethyl]propanamide
SMILESCc1cc(C)c(C(=O)CNC(=O)C(C)(C)C)c(C)c1
InChIInChI=1S/C16H23NO2/c1-10-7-11(2)14(12(3)8-10)13(18)9-17-15(19)16(4,5)6/h7-8H,9H2,1-6H3,(H,17,19)
InChIKeyGPMAXDHYTLUVNW-UHFFFAOYSA-N
MW261.36 g/mol
LogP2.96
Rot. Bonds3

About 2,2-dimethyl-N-[2-oxo-2-(2,4,6-trimethylphenyl)ethyl]propanamide

2,2-dimethyl-N-[2-oxo-2-(2,4,6-trimethylphenyl)ethyl]propanamide (PubChem CID 82121737) has the molecular formula C16H23NO2 and a molecular weight of 261.36 g/mol. Its IUPAC name is 2,2-dimethyl-N-[2-oxo-2-(2,4,6-trimethylphenyl)ethyl]propanamide.

Molecular Properties

Compound Name2,2-dimethyl-N-[2-oxo-2-(2,4,6-trimethylphenyl)ethyl]propanamide
PubChem CID82121737
Molecular FormulaC16H23NO2
Molecular Weight261.36 g/mol
Exact Mass261.17
IUPAC Name2,2-dimethyl-N-[2-oxo-2-(2,4,6-trimethylphenyl)ethyl]propanamide
SMILESCc1cc(C)c(C(=O)CNC(=O)C(C)(C)C)c(C)c1
InChIInChI=1S/C16H23NO2/c1-10-7-11(2)14(12(3)8-10)13(18)9-17-15(19)16(4,5)6/h7-8H,9H2,1-6H3,(H,17,19)
InChIKeyGPMAXDHYTLUVNW-UHFFFAOYSA-N
XLogP2.96
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.36
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-[2-oxo-2-(2,4,6-trimethylphenyl)ethyl]propanamide?
The IUPAC name of 2,2-dimethyl-N-[2-oxo-2-(2,4,6-trimethylphenyl)ethyl]propanamide (CID 82121737) is 2,2-dimethyl-N-[2-oxo-2-(2,4,6-trimethylphenyl)ethyl]propanamide.
What is the SMILES notation for 2,2-dimethyl-N-[2-oxo-2-(2,4,6-trimethylphenyl)ethyl]propanamide?
The canonical SMILES for 2,2-dimethyl-N-[2-oxo-2-(2,4,6-trimethylphenyl)ethyl]propanamide is Cc1cc(C)c(C(=O)CNC(=O)C(C)(C)C)c(C)c1.
What is the InChIKey of 2,2-dimethyl-N-[2-oxo-2-(2,4,6-trimethylphenyl)ethyl]propanamide?
The InChIKey is GPMAXDHYTLUVNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23NO2/c1-10-7-11(2)14(12(3)8-10)13(18)9-17-15(19)16(4,5)6/h7-8H,9H2,1-6H3,(H,17,19).
What are the key properties of 2,2-dimethyl-N-[2-oxo-2-(2,4,6-trimethylphenyl)ethyl]propanamide?
2,2-dimethyl-N-[2-oxo-2-(2,4,6-trimethylphenyl)ethyl]propanamide has a molecular weight of 261.36 g/mol, XLogP of 2.96, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-[2-oxo-2-(2,4,6-trimethylphenyl)ethyl]propanamide is sourced from PubChem (CID 82121737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).