N-[2-(diethylamino)-2-oxoethyl]-3,5-dimethylbenzamide

C15H22N2O2 — CID 51161803

IUPACN-[2-(diethylamino)-2-oxoethyl]-3,5-dimethylbenzamide
SMILESCCN(CC)C(=O)CNC(=O)c1cc(C)cc(C)c1
InChIInChI=1S/C15H22N2O2/c1-5-17(6-2)14(18)10-16-15(19)13-8-11(3)7-12(4)9-13/h7-9H,5-6,10H2,1-4H3,(H,16,19)
InChIKeyLEZLNUPAKFOKMT-UHFFFAOYSA-N
MW262.35 g/mol
LogP1.90
Rot. Bonds5

About N-[2-(diethylamino)-2-oxoethyl]-3,5-dimethylbenzamide

N-[2-(diethylamino)-2-oxoethyl]-3,5-dimethylbenzamide (PubChem CID 51161803) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is N-[2-(diethylamino)-2-oxoethyl]-3,5-dimethylbenzamide.

Molecular Properties

Compound NameN-[2-(diethylamino)-2-oxoethyl]-3,5-dimethylbenzamide
PubChem CID51161803
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC NameN-[2-(diethylamino)-2-oxoethyl]-3,5-dimethylbenzamide
SMILESCCN(CC)C(=O)CNC(=O)c1cc(C)cc(C)c1
InChIInChI=1S/C15H22N2O2/c1-5-17(6-2)14(18)10-16-15(19)13-8-11(3)7-12(4)9-13/h7-9H,5-6,10H2,1-4H3,(H,16,19)
InChIKeyLEZLNUPAKFOKMT-UHFFFAOYSA-N
XLogP1.90
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-bromo-N-[2-(diethylamino)-2-oxoethyl]-5-methylbenzamide
CID 113460828
ethyl 2-[(3,5-dimethylbenzoyl)amino]acetate
CID 46544273
2-(3,5-dimethylanilino)-N,N-diethylacetamide
CID 28582869
N-[2-[ethyl-[2-(3-methoxyanilino)-2-oxoethyl]amino]-2-oxoethyl]-3,5-dimethylbenzamide
CID 46582138
N-[2-[3-(diethylcarbamoyl)anilino]-2-oxoethyl]-3,5-dimethylbenzamide
CID 26712597
N-[2-(diethylamino)-2-oxoethyl]-3-sulfanylbenzamide
CID 107034454
N-[2-(diethylamino)-2-oxoethyl]-3,4-diethoxybenzamide
CID 34837733
3,5-dimethyl-N-[2-oxo-2-(propylamino)ethyl]benzamide
CID 27256307
2-[(3,5-dimethylphenyl)methylamino]-N,N-diethylacetamide
CID 112687465
N-[2-[cycloheptyl(methyl)amino]-2-oxoethyl]-3,5-dimethylbenzamide
CID 112805274
N-[2-(diethylamino)-2-oxoethyl]-2,3-dimethyl-1H-indole-5-carboxamide
CID 48503245
N-[2-[(1-hydroxy-3,3-dimethylbutan-2-yl)-methylamino]-2-oxoethyl]-3,5-dimethylbenzamide
CID 86797004

Frequently Asked Questions

What is the IUPAC name of N-[2-(diethylamino)-2-oxoethyl]-3,5-dimethylbenzamide?
The IUPAC name of N-[2-(diethylamino)-2-oxoethyl]-3,5-dimethylbenzamide (CID 51161803) is N-[2-(diethylamino)-2-oxoethyl]-3,5-dimethylbenzamide.
What is the SMILES notation for N-[2-(diethylamino)-2-oxoethyl]-3,5-dimethylbenzamide?
The canonical SMILES for N-[2-(diethylamino)-2-oxoethyl]-3,5-dimethylbenzamide is CCN(CC)C(=O)CNC(=O)c1cc(C)cc(C)c1.
What is the InChIKey of N-[2-(diethylamino)-2-oxoethyl]-3,5-dimethylbenzamide?
The InChIKey is LEZLNUPAKFOKMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-5-17(6-2)14(18)10-16-15(19)13-8-11(3)7-12(4)9-13/h7-9H,5-6,10H2,1-4H3,(H,16,19).
What are the key properties of N-[2-(diethylamino)-2-oxoethyl]-3,5-dimethylbenzamide?
N-[2-(diethylamino)-2-oxoethyl]-3,5-dimethylbenzamide has a molecular weight of 262.35 g/mol, XLogP of 1.90, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(diethylamino)-2-oxoethyl]-3,5-dimethylbenzamide is sourced from PubChem (CID 51161803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).