3-amino-N-(2,2-dimethylpropyl)-N-methyl-3-phenylpropanamide;hydrochloride

C15H25ClN2O — CID 119950369

IUPAC3-amino-N-(2,2-dimethylpropyl)-N-methyl-3-phenylpropanamide;hydrochloride
SMILESCN(CC(C)(C)C)C(=O)CC(N)c1ccccc1.Cl
InChIInChI=1S/C15H24N2O.ClH/c1-15(2,3)11-17(4)14(18)10-13(16)12-8-6-5-7-9-12;/h5-9,13H,10-11,16H2,1-4H3;1H
InChIKeyIJZOKDCODZADBS-UHFFFAOYSA-N
MW284.83 g/mol
LogP3.00
Rot. Bonds4

About 3-amino-N-(2,2-dimethylpropyl)-N-methyl-3-phenylpropanamide;hydrochloride

3-amino-N-(2,2-dimethylpropyl)-N-methyl-3-phenylpropanamide;hydrochloride (PubChem CID 119950369) has the molecular formula C15H25ClN2O and a molecular weight of 284.83 g/mol. Its IUPAC name is 3-amino-N-(2,2-dimethylpropyl)-N-methyl-3-phenylpropanamide;hydrochloride.

Molecular Properties

Compound Name3-amino-N-(2,2-dimethylpropyl)-N-methyl-3-phenylpropanamide;hydrochloride
PubChem CID119950369
Molecular FormulaC15H25ClN2O
Molecular Weight284.83 g/mol
Exact Mass284.17
IUPAC Name3-amino-N-(2,2-dimethylpropyl)-N-methyl-3-phenylpropanamide;hydrochloride
SMILESCN(CC(C)(C)C)C(=O)CC(N)c1ccccc1.Cl
InChIInChI=1S/C15H24N2O.ClH/c1-15(2,3)11-17(4)14(18)10-13(16)12-8-6-5-7-9-12;/h5-9,13H,10-11,16H2,1-4H3;1H
InChIKeyIJZOKDCODZADBS-UHFFFAOYSA-N
XLogP3.00
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.83
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-amino-N-ethyl-N-methyl-3-phenylpropanamide
CID 43263469
3-amino-N-(2,2-difluoroethyl)-N-methyl-3-phenylpropanamide;hydrochloride
CID 119950674
3-amino-N,N-dimethyl-3-phenylpropanamide
CID 24691874
3-amino-N-methyl-3-phenyl-N-(2-phenylethyl)propanamide
CID 60947587
3-amino-N-butan-2-yl-N-methyl-3-phenylpropanamide;hydrochloride
CID 119950260
3-amino-N-(cyclohexylmethyl)-N-methyl-3-phenylpropanamide
CID 60963492
3-amino-N-ethyl-3-phenyl-N-propan-2-ylpropanamide;hydrochloride
CID 119949409
3-amino-N-methyl-3-phenyl-N-(thiophen-3-ylmethyl)propanamide
CID 43528267
3-(4-aminophenyl)-N-(2,2-dimethylpropyl)-N-methylbutanamide
CID 104502518
3-amino-N-(3,5-dimethylphenyl)-N-methyl-3-phenylpropanamide
CID 119950423
(3S)-3-amino-N-methyl-N-[(2S)-1-methylsulfanylpropan-2-yl]-3-phenylpropanamide
CID 99601037
3-amino-N-methyl-3-phenyl-N-(1-phenylbutan-2-yl)propanamide;hydrochloride
CID 119952076

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(2,2-dimethylpropyl)-N-methyl-3-phenylpropanamide;hydrochloride?
The IUPAC name of 3-amino-N-(2,2-dimethylpropyl)-N-methyl-3-phenylpropanamide;hydrochloride (CID 119950369) is 3-amino-N-(2,2-dimethylpropyl)-N-methyl-3-phenylpropanamide;hydrochloride.
What is the SMILES notation for 3-amino-N-(2,2-dimethylpropyl)-N-methyl-3-phenylpropanamide;hydrochloride?
The canonical SMILES for 3-amino-N-(2,2-dimethylpropyl)-N-methyl-3-phenylpropanamide;hydrochloride is CN(CC(C)(C)C)C(=O)CC(N)c1ccccc1.Cl.
What is the InChIKey of 3-amino-N-(2,2-dimethylpropyl)-N-methyl-3-phenylpropanamide;hydrochloride?
The InChIKey is IJZOKDCODZADBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O.ClH/c1-15(2,3)11-17(4)14(18)10-13(16)12-8-6-5-7-9-12;/h5-9,13H,10-11,16H2,1-4H3;1H.
What are the key properties of 3-amino-N-(2,2-dimethylpropyl)-N-methyl-3-phenylpropanamide;hydrochloride?
3-amino-N-(2,2-dimethylpropyl)-N-methyl-3-phenylpropanamide;hydrochloride has a molecular weight of 284.83 g/mol, XLogP of 3.00, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(2,2-dimethylpropyl)-N-methyl-3-phenylpropanamide;hydrochloride is sourced from PubChem (CID 119950369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).