2-amino-N-[2-(dimethylamino)-3-methylbutyl]-2-phenylpropanamide

C16H27N3O — CID 62488600

IUPAC2-amino-N-[2-(dimethylamino)-3-methylbutyl]-2-phenylpropanamide
SMILESCC(C)C(CNC(=O)C(C)(N)c1ccccc1)N(C)C
InChIInChI=1S/C16H27N3O/c1-12(2)14(19(4)5)11-18-15(20)16(3,17)13-9-7-6-8-10-13/h6-10,12,14H,11,17H2,1-5H3,(H,18,20)
InChIKeyGPXPIZZRKVAENU-UHFFFAOYSA-N
MW277.41 g/mol
LogP1.56
Rot. Bonds6

About 2-amino-N-[2-(dimethylamino)-3-methylbutyl]-2-phenylpropanamide

2-amino-N-[2-(dimethylamino)-3-methylbutyl]-2-phenylpropanamide (PubChem CID 62488600) has the molecular formula C16H27N3O and a molecular weight of 277.41 g/mol. Its IUPAC name is 2-amino-N-[2-(dimethylamino)-3-methylbutyl]-2-phenylpropanamide.

Molecular Properties

Compound Name2-amino-N-[2-(dimethylamino)-3-methylbutyl]-2-phenylpropanamide
PubChem CID62488600
Molecular FormulaC16H27N3O
Molecular Weight277.41 g/mol
Exact Mass277.22
IUPAC Name2-amino-N-[2-(dimethylamino)-3-methylbutyl]-2-phenylpropanamide
SMILESCC(C)C(CNC(=O)C(C)(N)c1ccccc1)N(C)C
InChIInChI=1S/C16H27N3O/c1-12(2)14(19(4)5)11-18-15(20)16(3,17)13-9-7-6-8-10-13/h6-10,12,14H,11,17H2,1-5H3,(H,18,20)
InChIKeyGPXPIZZRKVAENU-UHFFFAOYSA-N
XLogP1.56
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.41
LogP ≤ 51.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-(2-methoxy-3-methylbutyl)-2-phenylpropanamide;hydrochloride
CID 120593921
2-amino-N-(2,2-difluoroethyl)-2-phenylpropanamide
CID 115406878
2-amino-N-(3-methyl-2-phenylbutyl)-2-phenylpropanamide;hydrochloride
CID 120589227
2-amino-N-(2-phenoxypropyl)-2-phenylpropanamide
CID 120589356
2-amino-N-[4-(dimethylamino)-2-ethoxybutyl]-2-phenylpropanamide;dihydrochloride
CID 120597356
2-amino-N-[2-(diethylamino)-4-methylpentyl]-2-phenylpropanamide;dihydrochloride
CID 120595114
2-[[(2-amino-2-phenylpropanoyl)amino]methyl]butanoic acid
CID 65224591
2-amino-N-[2-(dimethylamino)-3-methylbutyl]-2-methylbutanamide
CID 79805016
N-[2-[(2-amino-2-phenylpropanoyl)amino]ethyl]-2,2-dimethylpropanamide
CID 120591033
2-amino-N-(3-methylbutan-2-yl)-2-phenylpropanamide;hydrochloride
CID 120586686
2-amino-N-(2-cyclohexyl-2-hydroxyethyl)-2-phenylpropanamide
CID 120589210
2-amino-2-phenyl-N-(2,2,2-trifluoroethyl)propanamide;hydrochloride
CID 120588942

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-(dimethylamino)-3-methylbutyl]-2-phenylpropanamide?
The IUPAC name of 2-amino-N-[2-(dimethylamino)-3-methylbutyl]-2-phenylpropanamide (CID 62488600) is 2-amino-N-[2-(dimethylamino)-3-methylbutyl]-2-phenylpropanamide.
What is the SMILES notation for 2-amino-N-[2-(dimethylamino)-3-methylbutyl]-2-phenylpropanamide?
The canonical SMILES for 2-amino-N-[2-(dimethylamino)-3-methylbutyl]-2-phenylpropanamide is CC(C)C(CNC(=O)C(C)(N)c1ccccc1)N(C)C.
What is the InChIKey of 2-amino-N-[2-(dimethylamino)-3-methylbutyl]-2-phenylpropanamide?
The InChIKey is GPXPIZZRKVAENU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3O/c1-12(2)14(19(4)5)11-18-15(20)16(3,17)13-9-7-6-8-10-13/h6-10,12,14H,11,17H2,1-5H3,(H,18,20).
What are the key properties of 2-amino-N-[2-(dimethylamino)-3-methylbutyl]-2-phenylpropanamide?
2-amino-N-[2-(dimethylamino)-3-methylbutyl]-2-phenylpropanamide has a molecular weight of 277.41 g/mol, XLogP of 1.56, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-(dimethylamino)-3-methylbutyl]-2-phenylpropanamide is sourced from PubChem (CID 62488600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).