2-amino-N-[1-(3,5-dimethylphenyl)ethyl]-2-phenylacetamide;hydrochloride

C18H23ClN2O — CID 119320621

IUPAC2-amino-N-[1-(3,5-dimethylphenyl)ethyl]-2-phenylacetamide;hydrochloride
SMILESCc1cc(C)cc(C(C)NC(=O)C(N)c2ccccc2)c1.Cl
InChIInChI=1S/C18H22N2O.ClH/c1-12-9-13(2)11-16(10-12)14(3)20-18(21)17(19)15-7-5-4-6-8-15;/h4-11,14,17H,19H2,1-3H3,(H,20,21);1H
InChIKeyIAZVOOHGFADXEF-UHFFFAOYSA-N
MW318.85 g/mol
LogP3.60
Rot. Bonds4

About 2-amino-N-[1-(3,5-dimethylphenyl)ethyl]-2-phenylacetamide;hydrochloride

2-amino-N-[1-(3,5-dimethylphenyl)ethyl]-2-phenylacetamide;hydrochloride (PubChem CID 119320621) has the molecular formula C18H23ClN2O and a molecular weight of 318.85 g/mol. Its IUPAC name is 2-amino-N-[1-(3,5-dimethylphenyl)ethyl]-2-phenylacetamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-[1-(3,5-dimethylphenyl)ethyl]-2-phenylacetamide;hydrochloride
PubChem CID119320621
Molecular FormulaC18H23ClN2O
Molecular Weight318.85 g/mol
Exact Mass318.15
IUPAC Name2-amino-N-[1-(3,5-dimethylphenyl)ethyl]-2-phenylacetamide;hydrochloride
SMILESCc1cc(C)cc(C(C)NC(=O)C(N)c2ccccc2)c1.Cl
InChIInChI=1S/C18H22N2O.ClH/c1-12-9-13(2)11-16(10-12)14(3)20-18(21)17(19)15-7-5-4-6-8-15;/h4-11,14,17H,19H2,1-3H3,(H,20,21);1H
InChIKeyIAZVOOHGFADXEF-UHFFFAOYSA-N
XLogP3.60
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.85
LogP ≤ 53.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-2-amino-N-[(1R)-1-(4-methylphenyl)ethyl]-2-phenylacetamide
CID 81357033
2-amino-2-phenyl-N-[1-(4-propan-2-ylphenyl)ethyl]acetamide
CID 119269403
2-amino-N-[(1S)-1-(4-bromophenyl)ethyl]-2-phenylacetamide
CID 81359115
(2S)-2-amino-N-[1-(4-chlorophenyl)ethyl]-2-phenylacetamide
CID 104897669
(2S)-2-amino-N-[(1R)-1-(3-bromophenyl)ethyl]-2-phenylacetamide
CID 104898206
2-amino-2-phenyl-N-propan-2-ylacetamide;hydrochloride
CID 22262716
2-amino-N-(3,5-dimethylphenyl)-2-phenylacetamide
CID 24701080
2-amino-2-(4-methylphenyl)-N-[1-[3-(trifluoromethyl)phenyl]ethyl]acetamide;hydrochloride
CID 120666705
(2R)-2-amino-N-[(1R)-1-(3-methoxyphenyl)ethyl]-2-phenylacetamide
CID 81354308
2-amino-N-(4-hydroxy-4-phenylbutan-2-yl)-2-(4-methylphenyl)acetamide;hydrochloride
CID 120668952
2-amino-N-[1-[3-(difluoromethoxy)phenyl]ethyl]-2-(4-methylphenyl)acetamide
CID 120667280
2-amino-2-(3-methylphenyl)-N-propan-2-ylacetamide
CID 83532850

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[1-(3,5-dimethylphenyl)ethyl]-2-phenylacetamide;hydrochloride?
The IUPAC name of 2-amino-N-[1-(3,5-dimethylphenyl)ethyl]-2-phenylacetamide;hydrochloride (CID 119320621) is 2-amino-N-[1-(3,5-dimethylphenyl)ethyl]-2-phenylacetamide;hydrochloride.
What is the SMILES notation for 2-amino-N-[1-(3,5-dimethylphenyl)ethyl]-2-phenylacetamide;hydrochloride?
The canonical SMILES for 2-amino-N-[1-(3,5-dimethylphenyl)ethyl]-2-phenylacetamide;hydrochloride is Cc1cc(C)cc(C(C)NC(=O)C(N)c2ccccc2)c1.Cl.
What is the InChIKey of 2-amino-N-[1-(3,5-dimethylphenyl)ethyl]-2-phenylacetamide;hydrochloride?
The InChIKey is IAZVOOHGFADXEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O.ClH/c1-12-9-13(2)11-16(10-12)14(3)20-18(21)17(19)15-7-5-4-6-8-15;/h4-11,14,17H,19H2,1-3H3,(H,20,21);1H.
What are the key properties of 2-amino-N-[1-(3,5-dimethylphenyl)ethyl]-2-phenylacetamide;hydrochloride?
2-amino-N-[1-(3,5-dimethylphenyl)ethyl]-2-phenylacetamide;hydrochloride has a molecular weight of 318.85 g/mol, XLogP of 3.60, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[1-(3,5-dimethylphenyl)ethyl]-2-phenylacetamide;hydrochloride is sourced from PubChem (CID 119320621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).