3-amino-N-(4-hydroxyphenyl)-N,2-dimethyl-3-phenylpropanamide

C17H20N2O2 — CID 107734254

IUPAC3-amino-N-(4-hydroxyphenyl)-N,2-dimethyl-3-phenylpropanamide
SMILESCC(C(=O)N(C)c1ccc(O)cc1)C(N)c1ccccc1
InChIInChI=1S/C17H20N2O2/c1-12(16(18)13-6-4-3-5-7-13)17(21)19(2)14-8-10-15(20)11-9-14/h3-12,16,20H,18H2,1-2H3
InChIKeyMZCXLUKGAPKHIS-UHFFFAOYSA-N
MW284.36 g/mol
LogP2.69
Rot. Bonds4

About 3-amino-N-(4-hydroxyphenyl)-N,2-dimethyl-3-phenylpropanamide

3-amino-N-(4-hydroxyphenyl)-N,2-dimethyl-3-phenylpropanamide (PubChem CID 107734254) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is 3-amino-N-(4-hydroxyphenyl)-N,2-dimethyl-3-phenylpropanamide.

Molecular Properties

Compound Name3-amino-N-(4-hydroxyphenyl)-N,2-dimethyl-3-phenylpropanamide
PubChem CID107734254
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC Name3-amino-N-(4-hydroxyphenyl)-N,2-dimethyl-3-phenylpropanamide
SMILESCC(C(=O)N(C)c1ccc(O)cc1)C(N)c1ccccc1
InChIInChI=1S/C17H20N2O2/c1-12(16(18)13-6-4-3-5-7-13)17(21)19(2)14-8-10-15(20)11-9-14/h3-12,16,20H,18H2,1-2H3
InChIKeyMZCXLUKGAPKHIS-UHFFFAOYSA-N
XLogP2.69
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 52.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-(4-hydroxyphenyl)-N-methylpropanamide
CID 23221170
2-chloro-N-(4-hydroxyphenyl)-N-methyl-2-phenylacetamide
CID 82110850
2-[(3-amino-2-methyl-3-phenylpropanoyl)-methylamino]propanoic acid
CID 80552081
3-amino-2-methyl-N,N-bis(2-methylpropyl)-3-phenylpropanamide;hydrochloride
CID 119669067
2-chloro-N-(4-hydroxyphenyl)-N-methylpropanamide
CID 11063778
2-amino-N-(4-hydroxyphenyl)-N-methylbutanamide
CID 107734416
3-amino-N,2-dimethyl-N-[1-(4-methylphenyl)ethyl]-3-phenylpropanamide
CID 119717391
3-hydroxy-N-(4-hydroxyphenyl)-N,2-dimethylpropanamide
CID 134339239
3-amino-N-(1,3-benzothiazol-2-ylmethyl)-N,2-dimethyl-3-phenylpropanamide
CID 119835324
3-amino-N-(cyclopropylmethyl)-N,2-dimethyl-3-phenylpropanamide;hydrochloride
CID 119737873
3-amino-N-[(4-ethylphenyl)methyl]-N,2-dimethyl-3-phenylpropanamide
CID 119681290
3-amino-N,2-dimethyl-N-(4-methylcyclohexyl)-3-phenylpropanamide
CID 80548256

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(4-hydroxyphenyl)-N,2-dimethyl-3-phenylpropanamide?
The IUPAC name of 3-amino-N-(4-hydroxyphenyl)-N,2-dimethyl-3-phenylpropanamide (CID 107734254) is 3-amino-N-(4-hydroxyphenyl)-N,2-dimethyl-3-phenylpropanamide.
What is the SMILES notation for 3-amino-N-(4-hydroxyphenyl)-N,2-dimethyl-3-phenylpropanamide?
The canonical SMILES for 3-amino-N-(4-hydroxyphenyl)-N,2-dimethyl-3-phenylpropanamide is CC(C(=O)N(C)c1ccc(O)cc1)C(N)c1ccccc1.
What is the InChIKey of 3-amino-N-(4-hydroxyphenyl)-N,2-dimethyl-3-phenylpropanamide?
The InChIKey is MZCXLUKGAPKHIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c1-12(16(18)13-6-4-3-5-7-13)17(21)19(2)14-8-10-15(20)11-9-14/h3-12,16,20H,18H2,1-2H3.
What are the key properties of 3-amino-N-(4-hydroxyphenyl)-N,2-dimethyl-3-phenylpropanamide?
3-amino-N-(4-hydroxyphenyl)-N,2-dimethyl-3-phenylpropanamide has a molecular weight of 284.36 g/mol, XLogP of 2.69, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(4-hydroxyphenyl)-N,2-dimethyl-3-phenylpropanamide is sourced from PubChem (CID 107734254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).