N-[2-(4-ethylphenyl)-2-methylpropyl]-2-(methylamino)acetamide;hydrochloride

C15H25ClN2O — CID 119802083

IUPACN-[2-(4-ethylphenyl)-2-methylpropyl]-2-(methylamino)acetamide;hydrochloride
SMILESCCc1ccc(C(C)(C)CNC(=O)CNC)cc1.Cl
InChIInChI=1S/C15H24N2O.ClH/c1-5-12-6-8-13(9-7-12)15(2,3)11-17-14(18)10-16-4;/h6-9,16H,5,10-11H2,1-4H3,(H,17,18);1H
InChIKeyNJWFZUKWWKMUFV-UHFFFAOYSA-N
MW284.83 g/mol
LogP2.28
Rot. Bonds6

About N-[2-(4-ethylphenyl)-2-methylpropyl]-2-(methylamino)acetamide;hydrochloride

N-[2-(4-ethylphenyl)-2-methylpropyl]-2-(methylamino)acetamide;hydrochloride (PubChem CID 119802083) has the molecular formula C15H25ClN2O and a molecular weight of 284.83 g/mol. Its IUPAC name is N-[2-(4-ethylphenyl)-2-methylpropyl]-2-(methylamino)acetamide;hydrochloride.

Molecular Properties

Compound NameN-[2-(4-ethylphenyl)-2-methylpropyl]-2-(methylamino)acetamide;hydrochloride
PubChem CID119802083
Molecular FormulaC15H25ClN2O
Molecular Weight284.83 g/mol
Exact Mass284.17
IUPAC NameN-[2-(4-ethylphenyl)-2-methylpropyl]-2-(methylamino)acetamide;hydrochloride
SMILESCCc1ccc(C(C)(C)CNC(=O)CNC)cc1.Cl
InChIInChI=1S/C15H24N2O.ClH/c1-5-12-6-8-13(9-7-12)15(2,3)11-17-14(18)10-16-4;/h6-9,16H,5,10-11H2,1-4H3,(H,17,18);1H
InChIKeyNJWFZUKWWKMUFV-UHFFFAOYSA-N
XLogP2.28
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.83
LogP ≤ 52.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(4-chlorophenyl)-2-methylpropyl]-2-(methylamino)acetamide;hydrochloride
CID 119738056
2-(methylamino)-N-[2-methyl-2-(4-methylphenyl)propyl]acetamide
CID 115152154
2-(methylamino)-N-(2-methyl-2-phenylpropyl)acetamide
CID 60986486
1-amino-N-[2-(4-ethylphenyl)-2-methylpropyl]cyclopropane-1-carboxamide;hydrochloride
CID 119802066
4-amino-N-[2-(4-ethylphenyl)-2-methylpropyl]pentanamide
CID 120563338
4-(aminomethyl)-N-[2-(4-ethylphenyl)-2-methylpropyl]benzamide;hydrochloride
CID 119334153
N-[2-(3-fluorophenyl)-2-methylpropyl]-2-(methylamino)acetamide
CID 115152192
2-(methylamino)-N-[2-methyl-2-(2-methylphenyl)propyl]acetamide;hydrochloride
CID 119756879
1-[2-(4-ethylphenyl)-2-methylpropyl]-3-(3-hydroxypropyl)urea
CID 111861314
N-[2-(2-chlorophenyl)-2-methylpropyl]-2-(methylamino)acetamide;hydrochloride
CID 119773024
N-[2-(1,3-benzodioxol-5-yl)-2-methylpropyl]-2-(methylamino)acetamide
CID 115152169
N-[2-(4-ethylphenyl)-2-methylpropyl]piperidine-4-carboxamide
CID 119334148

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-ethylphenyl)-2-methylpropyl]-2-(methylamino)acetamide;hydrochloride?
The IUPAC name of N-[2-(4-ethylphenyl)-2-methylpropyl]-2-(methylamino)acetamide;hydrochloride (CID 119802083) is N-[2-(4-ethylphenyl)-2-methylpropyl]-2-(methylamino)acetamide;hydrochloride.
What is the SMILES notation for N-[2-(4-ethylphenyl)-2-methylpropyl]-2-(methylamino)acetamide;hydrochloride?
The canonical SMILES for N-[2-(4-ethylphenyl)-2-methylpropyl]-2-(methylamino)acetamide;hydrochloride is CCc1ccc(C(C)(C)CNC(=O)CNC)cc1.Cl.
What is the InChIKey of N-[2-(4-ethylphenyl)-2-methylpropyl]-2-(methylamino)acetamide;hydrochloride?
The InChIKey is NJWFZUKWWKMUFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O.ClH/c1-5-12-6-8-13(9-7-12)15(2,3)11-17-14(18)10-16-4;/h6-9,16H,5,10-11H2,1-4H3,(H,17,18);1H.
What are the key properties of N-[2-(4-ethylphenyl)-2-methylpropyl]-2-(methylamino)acetamide;hydrochloride?
N-[2-(4-ethylphenyl)-2-methylpropyl]-2-(methylamino)acetamide;hydrochloride has a molecular weight of 284.83 g/mol, XLogP of 2.28, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-ethylphenyl)-2-methylpropyl]-2-(methylamino)acetamide;hydrochloride is sourced from PubChem (CID 119802083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).