N-(3-amino-2,2-dimethylpropyl)-N-ethyl-3-phenylpropanamide

C16H26N2O — CID 79668144

IUPACN-(3-amino-2,2-dimethylpropyl)-N-ethyl-3-phenylpropanamide
SMILESCCN(CC(C)(C)CN)C(=O)CCc1ccccc1
InChIInChI=1S/C16H26N2O/c1-4-18(13-16(2,3)12-17)15(19)11-10-14-8-6-5-7-9-14/h5-9H,4,10-13,17H2,1-3H3
InChIKeyQOWNSWZJIIQWAQ-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.45
Rot. Bonds7

About N-(3-amino-2,2-dimethylpropyl)-N-ethyl-3-phenylpropanamide

N-(3-amino-2,2-dimethylpropyl)-N-ethyl-3-phenylpropanamide (PubChem CID 79668144) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is N-(3-amino-2,2-dimethylpropyl)-N-ethyl-3-phenylpropanamide.

Molecular Properties

Compound NameN-(3-amino-2,2-dimethylpropyl)-N-ethyl-3-phenylpropanamide
PubChem CID79668144
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC NameN-(3-amino-2,2-dimethylpropyl)-N-ethyl-3-phenylpropanamide
SMILESCCN(CC(C)(C)CN)C(=O)CCc1ccccc1
InChIInChI=1S/C16H26N2O/c1-4-18(13-16(2,3)12-17)15(19)11-10-14-8-6-5-7-9-14/h5-9H,4,10-13,17H2,1-3H3
InChIKeyQOWNSWZJIIQWAQ-UHFFFAOYSA-N
XLogP2.45
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(3-amino-2,2-dimethylpropyl)-N-ethyl-3-phenylpropanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(3-amino-2,2-dimethylpropyl)-N-ethyl-3-(furan-2-yl)propanamide
CID 79667566
N-(3-amino-2,2-dimethylpropyl)-N-ethyl-2-methyl-2-phenylpropanamide
CID 79668566
N-(3-amino-2,2-dimethylpropyl)-N-ethyl-2-(3-fluorophenyl)acetamide
CID 79668064
N-(2-aminoethyl)-3-phenyl-N-propylpropanamide
CID 61348391
N-(3-amino-2,2-dimethylpropyl)-3-(4-ethylphenyl)-N-methylpropanamide;hydrochloride
CID 119654388
3-(3-aminophenyl)-N-ethyl-N-(2-hydroxy-2-methylpropyl)propanamide
CID 79385637
N-dodecyl-N-ethyl-3-phenylpropanamide
CID 91693976
3-(3-aminophenyl)-N-benzyl-N-ethylpropanamide
CID 28713346
N-(3-amino-2,2-dimethylpropyl)-N-ethyl-2-iodobenzamide
CID 79668481
N-(2-aminoethyl)-3-phenyl-N-(2,2,2-trifluoroethyl)propanamide
CID 107493544
N-(3-amino-2,2-dimethylpropyl)-N-ethyl-2-thiophen-2-ylacetamide
CID 79667491
N-(3-amino-2,2-dimethylpropyl)-N-ethyl-2-(4-methoxyphenyl)acetamide
CID 79667818

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-2,2-dimethylpropyl)-N-ethyl-3-phenylpropanamide?
The IUPAC name of N-(3-amino-2,2-dimethylpropyl)-N-ethyl-3-phenylpropanamide (CID 79668144) is N-(3-amino-2,2-dimethylpropyl)-N-ethyl-3-phenylpropanamide.
What is the SMILES notation for N-(3-amino-2,2-dimethylpropyl)-N-ethyl-3-phenylpropanamide?
The canonical SMILES for N-(3-amino-2,2-dimethylpropyl)-N-ethyl-3-phenylpropanamide is CCN(CC(C)(C)CN)C(=O)CCc1ccccc1.
What is the InChIKey of N-(3-amino-2,2-dimethylpropyl)-N-ethyl-3-phenylpropanamide?
The InChIKey is QOWNSWZJIIQWAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-4-18(13-16(2,3)12-17)15(19)11-10-14-8-6-5-7-9-14/h5-9H,4,10-13,17H2,1-3H3.
What are the key properties of N-(3-amino-2,2-dimethylpropyl)-N-ethyl-3-phenylpropanamide?
N-(3-amino-2,2-dimethylpropyl)-N-ethyl-3-phenylpropanamide has a molecular weight of 262.40 g/mol, XLogP of 2.45, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-2,2-dimethylpropyl)-N-ethyl-3-phenylpropanamide is sourced from PubChem (CID 79668144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).