3-amino-N-(2-ethoxy-5-methoxyphenyl)-2-methyl-3-phenylpropanamide;hydrochloride

C19H25ClN2O3 — CID 119774050

IUPAC3-amino-N-(2-ethoxy-5-methoxyphenyl)-2-methyl-3-phenylpropanamide;hydrochloride
SMILESCCOc1ccc(OC)cc1NC(=O)C(C)C(N)c1ccccc1.Cl
InChIInChI=1S/C19H24N2O3.ClH/c1-4-24-17-11-10-15(23-3)12-16(17)21-19(22)13(2)18(20)14-8-6-5-7-9-14;/h5-13,18H,4,20H2,1-3H3,(H,21,22);1H
InChIKeyUNGQBPFZIACTJI-UHFFFAOYSA-N
MW364.87 g/mol
LogP3.79
Rot. Bonds7

About 3-amino-N-(2-ethoxy-5-methoxyphenyl)-2-methyl-3-phenylpropanamide;hydrochloride

3-amino-N-(2-ethoxy-5-methoxyphenyl)-2-methyl-3-phenylpropanamide;hydrochloride (PubChem CID 119774050) has the molecular formula C19H25ClN2O3 and a molecular weight of 364.87 g/mol. Its IUPAC name is 3-amino-N-(2-ethoxy-5-methoxyphenyl)-2-methyl-3-phenylpropanamide;hydrochloride.

Molecular Properties

Compound Name3-amino-N-(2-ethoxy-5-methoxyphenyl)-2-methyl-3-phenylpropanamide;hydrochloride
PubChem CID119774050
Molecular FormulaC19H25ClN2O3
Molecular Weight364.87 g/mol
Exact Mass364.16
IUPAC Name3-amino-N-(2-ethoxy-5-methoxyphenyl)-2-methyl-3-phenylpropanamide;hydrochloride
SMILESCCOc1ccc(OC)cc1NC(=O)C(C)C(N)c1ccccc1.Cl
InChIInChI=1S/C19H24N2O3.ClH/c1-4-24-17-11-10-15(23-3)12-16(17)21-19(22)13(2)18(20)14-8-6-5-7-9-14;/h5-13,18H,4,20H2,1-3H3,(H,21,22);1H
InChIKeyUNGQBPFZIACTJI-UHFFFAOYSA-N
XLogP3.79
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.87
LogP ≤ 53.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-amino-N-(2,5-dimethoxyphenyl)-2-methyl-3-phenylpropanamide;hydrochloride
CID 119674271
methyl 2-[(3-amino-2-methyl-3-phenylpropanoyl)amino]-5-methoxybenzoate;hydrochloride
CID 119752196
4-[(3-amino-2-methyl-3-phenylpropanoyl)amino]-3-ethoxy-N,N-dimethylbenzamide;hydrochloride
CID 119812590
3-amino-N-(3,5-dimethoxyphenyl)-2-methyl-3-phenylpropanamide
CID 119673892
(2S)-N-(2,5-diethoxyphenyl)-2-(6-methoxynaphthalen-2-yl)propanamide
CID 9118488
3-amino-N-[2-(2,5-dimethoxyphenyl)ethyl]-2-methyl-3-phenylpropanamide
CID 119705610
3-amino-N-[5-fluoro-2-(2,2,2-trifluoroethoxy)phenyl]-2-methyl-3-phenylpropanamide
CID 119702544
3-amino-N-(2-ethoxy-5-methoxyphenyl)propanamide
CID 119318009
3-amino-N-(3,4-dimethoxyphenyl)-2-methyl-3-phenylpropanamide
CID 119673644
N-(2,5-diethoxyphenyl)-2-methoxypropanamide
CID 47301395
3-amino-N-[1-(4-methoxyphenyl)propyl]-2-methyl-3-phenylpropanamide
CID 119689348
3-amino-2-methyl-3-phenyl-N-[2-(2,2,2-trifluoroethoxy)phenyl]propanamide;hydrochloride
CID 119700402

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(2-ethoxy-5-methoxyphenyl)-2-methyl-3-phenylpropanamide;hydrochloride?
The IUPAC name of 3-amino-N-(2-ethoxy-5-methoxyphenyl)-2-methyl-3-phenylpropanamide;hydrochloride (CID 119774050) is 3-amino-N-(2-ethoxy-5-methoxyphenyl)-2-methyl-3-phenylpropanamide;hydrochloride.
What is the SMILES notation for 3-amino-N-(2-ethoxy-5-methoxyphenyl)-2-methyl-3-phenylpropanamide;hydrochloride?
The canonical SMILES for 3-amino-N-(2-ethoxy-5-methoxyphenyl)-2-methyl-3-phenylpropanamide;hydrochloride is CCOc1ccc(OC)cc1NC(=O)C(C)C(N)c1ccccc1.Cl.
What is the InChIKey of 3-amino-N-(2-ethoxy-5-methoxyphenyl)-2-methyl-3-phenylpropanamide;hydrochloride?
The InChIKey is UNGQBPFZIACTJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O3.ClH/c1-4-24-17-11-10-15(23-3)12-16(17)21-19(22)13(2)18(20)14-8-6-5-7-9-14;/h5-13,18H,4,20H2,1-3H3,(H,21,22);1H.
What are the key properties of 3-amino-N-(2-ethoxy-5-methoxyphenyl)-2-methyl-3-phenylpropanamide;hydrochloride?
3-amino-N-(2-ethoxy-5-methoxyphenyl)-2-methyl-3-phenylpropanamide;hydrochloride has a molecular weight of 364.87 g/mol, XLogP of 3.79, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(2-ethoxy-5-methoxyphenyl)-2-methyl-3-phenylpropanamide;hydrochloride is sourced from PubChem (CID 119774050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).