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

C15H24N2O — CID 114028856

IUPACN-(3-amino-2,2-dimethylpropyl)-N-methyl-2-phenylpropanamide
SMILESCC(C(=O)N(C)CC(C)(C)CN)c1ccccc1
InChIInChI=1S/C15H24N2O/c1-12(13-8-6-5-7-9-13)14(18)17(4)11-15(2,3)10-16/h5-9,12H,10-11,16H2,1-4H3
InChIKeyRKZDICVWEVWSLD-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.23
Rot. Bonds5

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

N-(3-amino-2,2-dimethylpropyl)-N-methyl-2-phenylpropanamide (PubChem CID 114028856) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is N-(3-amino-2,2-dimethylpropyl)-N-methyl-2-phenylpropanamide.

Molecular Properties

Compound NameN-(3-amino-2,2-dimethylpropyl)-N-methyl-2-phenylpropanamide
PubChem CID114028856
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC NameN-(3-amino-2,2-dimethylpropyl)-N-methyl-2-phenylpropanamide
SMILESCC(C(=O)N(C)CC(C)(C)CN)c1ccccc1
InChIInChI=1S/C15H24N2O/c1-12(13-8-6-5-7-9-13)14(18)17(4)11-15(2,3)10-16/h5-9,12H,10-11,16H2,1-4H3
InChIKeyRKZDICVWEVWSLD-UHFFFAOYSA-N
XLogP2.23
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-[(3-amino-2,2-dimethylpropyl)-methylamino]-2-oxo-1-phenylethyl]-3-methylbutanamide;hydrochloride
CID 119653358
N-(3-amino-2,2-dimethylpropyl)-N-methyl-2-(3-propan-2-ylphenoxy)propanamide
CID 119653171
N-(3-amino-2,2-dimethylpropyl)-N-methyl-2-(2-oxopiperidin-1-yl)-2-phenylacetamide
CID 119654619
N-(3-amino-2,2-dimethylpropyl)-N-methyl-2-(3-propan-2-ylphenoxy)propanamide;hydrochloride
CID 119653170
N',2,2-trimethyl-N'-(1-phenylethyl)propane-1,3-diamine;hydrochloride
CID 119928713
N-(3-amino-2,2-dimethylpropyl)-N-methyl-2-(5-phenyltetrazol-2-yl)propanamide;hydrochloride
CID 119657176
N-(3-amino-2,2-dimethylpropyl)-2,2-difluoro-N-methylacetamide
CID 103514230
methyl 3-[(3-amino-2,2-dimethylpropyl)-methylamino]-2-phenylpropanoate
CID 79652279
N-(3-amino-2,2-dimethylpropyl)-N-methyl-2-phenylpropane-1-sulfonamide
CID 80686410
N-(3-amino-2,2-dimethylpropyl)-N-methyl-2-phenoxyacetamide;hydrochloride
CID 119652959
N-(3-amino-2,2-dimethylpropyl)-N-methyl-2-propan-2-ylsulfanylbenzamide
CID 119655514
(2S)-N-methyl-N-phenacyl-2-phenylpropanamide
CID 78324200

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-2,2-dimethylpropyl)-N-methyl-2-phenylpropanamide?
The IUPAC name of N-(3-amino-2,2-dimethylpropyl)-N-methyl-2-phenylpropanamide (CID 114028856) is N-(3-amino-2,2-dimethylpropyl)-N-methyl-2-phenylpropanamide.
What is the SMILES notation for N-(3-amino-2,2-dimethylpropyl)-N-methyl-2-phenylpropanamide?
The canonical SMILES for N-(3-amino-2,2-dimethylpropyl)-N-methyl-2-phenylpropanamide is CC(C(=O)N(C)CC(C)(C)CN)c1ccccc1.
What is the InChIKey of N-(3-amino-2,2-dimethylpropyl)-N-methyl-2-phenylpropanamide?
The InChIKey is RKZDICVWEVWSLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-12(13-8-6-5-7-9-13)14(18)17(4)11-15(2,3)10-16/h5-9,12H,10-11,16H2,1-4H3.
What are the key properties of N-(3-amino-2,2-dimethylpropyl)-N-methyl-2-phenylpropanamide?
N-(3-amino-2,2-dimethylpropyl)-N-methyl-2-phenylpropanamide has a molecular weight of 248.37 g/mol, XLogP of 2.23, 5 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-methyl-2-phenylpropanamide is sourced from PubChem (CID 114028856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).