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

C17H28N2O — CID 79668566

IUPACN-(3-amino-2,2-dimethylpropyl)-N-ethyl-2-methyl-2-phenylpropanamide
SMILESCCN(CC(C)(C)CN)C(=O)C(C)(C)c1ccccc1
InChIInChI=1S/C17H28N2O/c1-6-19(13-16(2,3)12-18)15(20)17(4,5)14-10-8-7-9-11-14/h7-11H,6,12-13,18H2,1-5H3
InChIKeyHUAPAVFUDSFIEY-UHFFFAOYSA-N
MW276.42 g/mol
LogP2.80
Rot. Bonds6

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

N-(3-amino-2,2-dimethylpropyl)-N-ethyl-2-methyl-2-phenylpropanamide (PubChem CID 79668566) has the molecular formula C17H28N2O and a molecular weight of 276.42 g/mol. Its IUPAC name is N-(3-amino-2,2-dimethylpropyl)-N-ethyl-2-methyl-2-phenylpropanamide.

Molecular Properties

Compound NameN-(3-amino-2,2-dimethylpropyl)-N-ethyl-2-methyl-2-phenylpropanamide
PubChem CID79668566
Molecular FormulaC17H28N2O
Molecular Weight276.42 g/mol
Exact Mass276.22
IUPAC NameN-(3-amino-2,2-dimethylpropyl)-N-ethyl-2-methyl-2-phenylpropanamide
SMILESCCN(CC(C)(C)CN)C(=O)C(C)(C)c1ccccc1
InChIInChI=1S/C17H28N2O/c1-6-19(13-16(2,3)12-18)15(20)17(4,5)14-10-8-7-9-11-14/h7-11H,6,12-13,18H2,1-5H3
InChIKeyHUAPAVFUDSFIEY-UHFFFAOYSA-N
XLogP2.80
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.42
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-amino-2,2-dimethylpropyl)-N-ethyl-3-phenylpropanamide
CID 79668144
N-(2-aminoethyl)-2-methyl-2-phenyl-N-(2,2,2-trifluoroethyl)propanamide
CID 107493677
N-(3-amino-2,2-dimethylpropyl)-N-ethyl-2-iodobenzamide
CID 79668481
N-(3-amino-2,2-dimethylpropyl)-N-ethyl-4-hydroxybenzamide
CID 79668244
N-(3-amino-2,2-dimethylpropyl)-N-ethylquinoline-2-carboxamide
CID 79663389
N-(3-amino-2,2-dimethylpropyl)-N-ethyl-3-hydroxybenzamide
CID 79667906
N-(3-amino-2,2-dimethylpropyl)-N-ethyl-2-fluoro-3-methylbenzamide
CID 81477271
N-(3-amino-2,2-dimethylpropyl)-N,2-dimethyl-2-(4-methylphenyl)propanamide;hydrochloride
CID 119653380
N-(3-amino-2,2-dimethylpropyl)-2-(4-fluorophenyl)-N,2-dimethylpropanamide
CID 119654096
N-(3-amino-2,2-dimethylpropyl)-N-ethyl-2-thiophen-2-ylacetamide
CID 79667491
N-(cyanomethyl)-2-methyl-2-phenyl-N-propylpropanamide
CID 61224496
N-(2-bromoethyl)-2-methyl-2-phenyl-N-(2,2,2-trifluoroethyl)propanamide
CID 107492581

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-2,2-dimethylpropyl)-N-ethyl-2-methyl-2-phenylpropanamide?
The IUPAC name of N-(3-amino-2,2-dimethylpropyl)-N-ethyl-2-methyl-2-phenylpropanamide (CID 79668566) is N-(3-amino-2,2-dimethylpropyl)-N-ethyl-2-methyl-2-phenylpropanamide.
What is the SMILES notation for N-(3-amino-2,2-dimethylpropyl)-N-ethyl-2-methyl-2-phenylpropanamide?
The canonical SMILES for N-(3-amino-2,2-dimethylpropyl)-N-ethyl-2-methyl-2-phenylpropanamide is CCN(CC(C)(C)CN)C(=O)C(C)(C)c1ccccc1.
What is the InChIKey of N-(3-amino-2,2-dimethylpropyl)-N-ethyl-2-methyl-2-phenylpropanamide?
The InChIKey is HUAPAVFUDSFIEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2O/c1-6-19(13-16(2,3)12-18)15(20)17(4,5)14-10-8-7-9-11-14/h7-11H,6,12-13,18H2,1-5H3.
What are the key properties of N-(3-amino-2,2-dimethylpropyl)-N-ethyl-2-methyl-2-phenylpropanamide?
N-(3-amino-2,2-dimethylpropyl)-N-ethyl-2-methyl-2-phenylpropanamide has a molecular weight of 276.42 g/mol, XLogP of 2.80, 6 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-2-methyl-2-phenylpropanamide is sourced from PubChem (CID 79668566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).