3-amino-N-(2,6-diethylphenyl)-N-ethylpropanamide

C15H24N2O — CID 28795326

IUPAC3-amino-N-(2,6-diethylphenyl)-N-ethylpropanamide
SMILESCCc1cccc(CC)c1N(CC)C(=O)CCN
InChIInChI=1S/C15H24N2O/c1-4-12-8-7-9-13(5-2)15(12)17(6-3)14(18)10-11-16/h7-9H,4-6,10-11,16H2,1-3H3
InChIKeyXAKJQBMHNBWXKJ-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.51
Rot. Bonds6

About 3-amino-N-(2,6-diethylphenyl)-N-ethylpropanamide

3-amino-N-(2,6-diethylphenyl)-N-ethylpropanamide (PubChem CID 28795326) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 3-amino-N-(2,6-diethylphenyl)-N-ethylpropanamide.

Molecular Properties

Compound Name3-amino-N-(2,6-diethylphenyl)-N-ethylpropanamide
PubChem CID28795326
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name3-amino-N-(2,6-diethylphenyl)-N-ethylpropanamide
SMILESCCc1cccc(CC)c1N(CC)C(=O)CCN
InChIInChI=1S/C15H24N2O/c1-4-12-8-7-9-13(5-2)15(12)17(6-3)14(18)10-11-16/h7-9H,4-6,10-11,16H2,1-3H3
InChIKeyXAKJQBMHNBWXKJ-UHFFFAOYSA-N
XLogP2.51
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-amino-N-(2,6-dichlorophenyl)-N-ethylpropanamide
CID 28795530
2-chloro-N-(2,6-diethylphenyl)-N-ethylacetamide
CID 163807844
3-amino-N-(2-ethyl-6-methylphenyl)-N-methylpropanamide
CID 28795015
3-(diaminomethylidene)-1-(2,6-diethylphenyl)-1-ethylurea;hydrochloride
CID 3052260
3-amino-N-ethyl-N-(3-methylphenyl)propanamide
CID 22692119
3-amino-N-(4-bromophenyl)-N-ethylpropanamide
CID 28795394
3-(N-acetyl-2,6-diethylanilino)-N-ethyl-N-phenylpropanamide
CID 113126202
3-amino-N-(3-chloro-2-methylphenyl)-N-ethylpropanamide
CID 28795362
3-amino-N-(1,3-benzodioxol-5-yl)-N-ethylpropanamide
CID 28795490
4-amino-N-ethyl-N-phenylbutanamide;hydrochloride
CID 119261842
[2-[2,6-diethyl-N-(methoxymethyl)anilino]-2-oxoethyl] acetate
CID 165437646
2-[2-(aminomethyl)phenyl]-N-ethyl-N-(2-fluorophenyl)acetamide
CID 81312468

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(2,6-diethylphenyl)-N-ethylpropanamide?
The IUPAC name of 3-amino-N-(2,6-diethylphenyl)-N-ethylpropanamide (CID 28795326) is 3-amino-N-(2,6-diethylphenyl)-N-ethylpropanamide.
What is the SMILES notation for 3-amino-N-(2,6-diethylphenyl)-N-ethylpropanamide?
The canonical SMILES for 3-amino-N-(2,6-diethylphenyl)-N-ethylpropanamide is CCc1cccc(CC)c1N(CC)C(=O)CCN.
What is the InChIKey of 3-amino-N-(2,6-diethylphenyl)-N-ethylpropanamide?
The InChIKey is XAKJQBMHNBWXKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-4-12-8-7-9-13(5-2)15(12)17(6-3)14(18)10-11-16/h7-9H,4-6,10-11,16H2,1-3H3.
What are the key properties of 3-amino-N-(2,6-diethylphenyl)-N-ethylpropanamide?
3-amino-N-(2,6-diethylphenyl)-N-ethylpropanamide has a molecular weight of 248.37 g/mol, XLogP of 2.51, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(2,6-diethylphenyl)-N-ethylpropanamide is sourced from PubChem (CID 28795326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).