3-amino-N-(2-ethoxyethyl)-N,2-dimethyl-3-phenylpropanamide

C15H24N2O2 — CID 81059342

IUPAC3-amino-N-(2-ethoxyethyl)-N,2-dimethyl-3-phenylpropanamide
SMILESCCOCCN(C)C(=O)C(C)C(N)c1ccccc1
InChIInChI=1S/C15H24N2O2/c1-4-19-11-10-17(3)15(18)12(2)14(16)13-8-6-5-7-9-13/h5-9,12,14H,4,10-11,16H2,1-3H3
InChIKeyVEQBSMKAUCHXBV-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.82
Rot. Bonds7

About 3-amino-N-(2-ethoxyethyl)-N,2-dimethyl-3-phenylpropanamide

3-amino-N-(2-ethoxyethyl)-N,2-dimethyl-3-phenylpropanamide (PubChem CID 81059342) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 3-amino-N-(2-ethoxyethyl)-N,2-dimethyl-3-phenylpropanamide.

Molecular Properties

Compound Name3-amino-N-(2-ethoxyethyl)-N,2-dimethyl-3-phenylpropanamide
PubChem CID81059342
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name3-amino-N-(2-ethoxyethyl)-N,2-dimethyl-3-phenylpropanamide
SMILESCCOCCN(C)C(=O)C(C)C(N)c1ccccc1
InChIInChI=1S/C15H24N2O2/c1-4-19-11-10-17(3)15(18)12(2)14(16)13-8-6-5-7-9-13/h5-9,12,14H,4,10-11,16H2,1-3H3
InChIKeyVEQBSMKAUCHXBV-UHFFFAOYSA-N
XLogP1.82
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3-amino-N,2-dimethyl-N-[2-(4-methylphenoxy)ethyl]-3-phenylpropanamide
CID 119695394
3-amino-N-(5-hydroxypentyl)-N,2-dimethyl-3-phenylpropanamide
CID 107199250
3-amino-N,2-dimethyl-3-phenyl-N-(2-pyrazol-1-ylethyl)propanamide
CID 119886219
(2S)-2-amino-N-(2-ethoxyethyl)-N-methyl-4-phenylbutanamide
CID 104984632
2-amino-N-methyl-2-phenyl-N-(2-phenylmethoxyethyl)acetamide
CID 119345164
3-amino-N-[(4-ethylphenyl)methyl]-N,2-dimethyl-3-phenylpropanamide
CID 119681290
N-(2-ethoxyethyl)-N-methylbenzamide
CID 81074695
(2R)-2-amino-N-(2-ethoxyethyl)-N-ethyl-2-phenylacetamide
CID 63692706
ethyl (2R,3S)-3-amino-2-methyl-3-phenylpropanoate
CID 142202479
3-amino-N-ethyl-N-(2-hydroxyethyl)-2-methyl-3-phenylpropanamide
CID 80552105
3-amino-N-(cyclopropylmethyl)-N,2-dimethyl-3-phenylpropanamide;hydrochloride
CID 119737873
(2S)-2-amino-N-[2-(cyclopropylmethoxy)ethyl]-N-methyl-2-phenylacetamide
CID 104898158

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(2-ethoxyethyl)-N,2-dimethyl-3-phenylpropanamide?
The IUPAC name of 3-amino-N-(2-ethoxyethyl)-N,2-dimethyl-3-phenylpropanamide (CID 81059342) is 3-amino-N-(2-ethoxyethyl)-N,2-dimethyl-3-phenylpropanamide.
What is the SMILES notation for 3-amino-N-(2-ethoxyethyl)-N,2-dimethyl-3-phenylpropanamide?
The canonical SMILES for 3-amino-N-(2-ethoxyethyl)-N,2-dimethyl-3-phenylpropanamide is CCOCCN(C)C(=O)C(C)C(N)c1ccccc1.
What is the InChIKey of 3-amino-N-(2-ethoxyethyl)-N,2-dimethyl-3-phenylpropanamide?
The InChIKey is VEQBSMKAUCHXBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-4-19-11-10-17(3)15(18)12(2)14(16)13-8-6-5-7-9-13/h5-9,12,14H,4,10-11,16H2,1-3H3.
What are the key properties of 3-amino-N-(2-ethoxyethyl)-N,2-dimethyl-3-phenylpropanamide?
3-amino-N-(2-ethoxyethyl)-N,2-dimethyl-3-phenylpropanamide has a molecular weight of 264.37 g/mol, XLogP of 1.82, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(2-ethoxyethyl)-N,2-dimethyl-3-phenylpropanamide is sourced from PubChem (CID 81059342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).