N-(2-ethyl-2-phenylbutyl)-2-(methylamino)acetamide;hydrochloride

C15H25ClN2O — CID 119808349

IUPACN-(2-ethyl-2-phenylbutyl)-2-(methylamino)acetamide;hydrochloride
SMILESCCC(CC)(CNC(=O)CNC)c1ccccc1.Cl
InChIInChI=1S/C15H24N2O.ClH/c1-4-15(5-2,12-17-14(18)11-16-3)13-9-7-6-8-10-13;/h6-10,16H,4-5,11-12H2,1-3H3,(H,17,18);1H
InChIKeyHPSMQKGTEDINCN-UHFFFAOYSA-N
MW284.83 g/mol
LogP2.50
Rot. Bonds7

About N-(2-ethyl-2-phenylbutyl)-2-(methylamino)acetamide;hydrochloride

N-(2-ethyl-2-phenylbutyl)-2-(methylamino)acetamide;hydrochloride (PubChem CID 119808349) has the molecular formula C15H25ClN2O and a molecular weight of 284.83 g/mol. Its IUPAC name is N-(2-ethyl-2-phenylbutyl)-2-(methylamino)acetamide;hydrochloride.

Molecular Properties

Compound NameN-(2-ethyl-2-phenylbutyl)-2-(methylamino)acetamide;hydrochloride
PubChem CID119808349
Molecular FormulaC15H25ClN2O
Molecular Weight284.83 g/mol
Exact Mass284.17
IUPAC NameN-(2-ethyl-2-phenylbutyl)-2-(methylamino)acetamide;hydrochloride
SMILESCCC(CC)(CNC(=O)CNC)c1ccccc1.Cl
InChIInChI=1S/C15H24N2O.ClH/c1-4-15(5-2,12-17-14(18)11-16-3)13-9-7-6-8-10-13;/h6-10,16H,4-5,11-12H2,1-3H3,(H,17,18);1H
InChIKeyHPSMQKGTEDINCN-UHFFFAOYSA-N
XLogP2.50
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.83
LogP ≤ 52.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-ethyl-2-phenylbutyl)-2-(methylamino)acetamide
CID 119808350
2-(methylamino)-N-(2-methyl-2-phenylpropyl)acetamide
CID 60986486
4-amino-N-(2-ethyl-2-phenylbutyl)pentanamide;hydrochloride
CID 120563575
2-ethyl-N-methyl-2-phenylbutan-1-amine
CID 62596018
1-amino-N-(2-ethyl-2-phenylbutyl)cyclopentane-1-carboxamide
CID 119337633
2-(methylaminomethyl)-2-phenylbutan-1-ol
CID 13463568
1-(2-ethyl-2-phenylbutyl)-2,3-dimethylguanidine;hydroiodide
CID 111465793
N-[2-(4-ethylphenyl)-2-methylpropyl]-2-(methylamino)acetamide;hydrochloride
CID 119802083
2-(methylamino)-N-[2-methyl-2-(2-methylphenyl)propyl]acetamide;hydrochloride
CID 119756879
5-[(2-ethyl-2-phenylbutyl)carbamoyl]pyrazine-2-carboxylic acid
CID 120685814
N-[2-(4-chlorophenyl)-2-methylpropyl]-2-(methylamino)acetamide;hydrochloride
CID 119738056
N-[2-(2-chlorophenyl)-2-methylpropyl]-2-(methylamino)acetamide;hydrochloride
CID 119773024

Frequently Asked Questions

What is the IUPAC name of N-(2-ethyl-2-phenylbutyl)-2-(methylamino)acetamide;hydrochloride?
The IUPAC name of N-(2-ethyl-2-phenylbutyl)-2-(methylamino)acetamide;hydrochloride (CID 119808349) is N-(2-ethyl-2-phenylbutyl)-2-(methylamino)acetamide;hydrochloride.
What is the SMILES notation for N-(2-ethyl-2-phenylbutyl)-2-(methylamino)acetamide;hydrochloride?
The canonical SMILES for N-(2-ethyl-2-phenylbutyl)-2-(methylamino)acetamide;hydrochloride is CCC(CC)(CNC(=O)CNC)c1ccccc1.Cl.
What is the InChIKey of N-(2-ethyl-2-phenylbutyl)-2-(methylamino)acetamide;hydrochloride?
The InChIKey is HPSMQKGTEDINCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O.ClH/c1-4-15(5-2,12-17-14(18)11-16-3)13-9-7-6-8-10-13;/h6-10,16H,4-5,11-12H2,1-3H3,(H,17,18);1H.
What are the key properties of N-(2-ethyl-2-phenylbutyl)-2-(methylamino)acetamide;hydrochloride?
N-(2-ethyl-2-phenylbutyl)-2-(methylamino)acetamide;hydrochloride has a molecular weight of 284.83 g/mol, XLogP of 2.50, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethyl-2-phenylbutyl)-2-(methylamino)acetamide;hydrochloride is sourced from PubChem (CID 119808349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).