3-amino-N-[2-(4-methoxyphenyl)ethyl]-2-methyl-3-phenylpropanamide

C19H24N2O2 — CID 119673161

IUPAC3-amino-N-[2-(4-methoxyphenyl)ethyl]-2-methyl-3-phenylpropanamide
SMILESCOc1ccc(CCNC(=O)C(C)C(N)c2ccccc2)cc1
InChIInChI=1S/C19H24N2O2/c1-14(18(20)16-6-4-3-5-7-16)19(22)21-13-12-15-8-10-17(23-2)11-9-15/h3-11,14,18H,12-13,20H2,1-2H3,(H,21,22)
InChIKeyBTEZCZUKAOSSFX-UHFFFAOYSA-N
MW312.41 g/mol
LogP2.69
Rot. Bonds7

About 3-amino-N-[2-(4-methoxyphenyl)ethyl]-2-methyl-3-phenylpropanamide

3-amino-N-[2-(4-methoxyphenyl)ethyl]-2-methyl-3-phenylpropanamide (PubChem CID 119673161) has the molecular formula C19H24N2O2 and a molecular weight of 312.41 g/mol. Its IUPAC name is 3-amino-N-[2-(4-methoxyphenyl)ethyl]-2-methyl-3-phenylpropanamide.

Molecular Properties

Compound Name3-amino-N-[2-(4-methoxyphenyl)ethyl]-2-methyl-3-phenylpropanamide
PubChem CID119673161
Molecular FormulaC19H24N2O2
Molecular Weight312.41 g/mol
Exact Mass312.18
IUPAC Name3-amino-N-[2-(4-methoxyphenyl)ethyl]-2-methyl-3-phenylpropanamide
SMILESCOc1ccc(CCNC(=O)C(C)C(N)c2ccccc2)cc1
InChIInChI=1S/C19H24N2O2/c1-14(18(20)16-6-4-3-5-7-16)19(22)21-13-12-15-8-10-17(23-2)11-9-15/h3-11,14,18H,12-13,20H2,1-2H3,(H,21,22)
InChIKeyBTEZCZUKAOSSFX-UHFFFAOYSA-N
XLogP2.69
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.41
LogP ≤ 52.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-amino-N-[2-(4-methoxyphenyl)ethyl]-2-methyl-3-phenylpropanamide with MolForge

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Related Compounds

methyl 4-[2-[(3-amino-2-methyl-3-phenylpropanoyl)amino]ethyl]benzoate
CID 119701393
3-amino-N-[2-(2,5-dimethoxyphenyl)ethyl]-2-methyl-3-phenylpropanamide
CID 119705610
2-amino-N-[2-(4-methoxyphenyl)ethyl]propanamide
CID 24710031
3-amino-2-methyl-3-phenyl-N-[2-(2,4,6-trimethoxyphenyl)ethyl]propanamide;hydrochloride
CID 119778880
(2R)-2-(benzhydrylamino)-N-[2-(4-methoxyphenyl)ethyl]propanamide
CID 9445831
3-amino-N-[2-(4-methoxyphenyl)ethyl]-3-phenylpropanamide;hydrochloride
CID 119948729
2-amino-N-[3-(4-methoxyphenyl)propyl]-2-phenylacetamide
CID 119299639
3-amino-N-[1-(4-methoxyphenyl)ethyl]-2-methyl-3-phenylpropanamide;hydrochloride
CID 119706532
3-amino-N-[2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]-2-methyl-3-phenylpropanamide;dihydrochloride
CID 119829693
3-amino-N-[[1-[(4-methoxyphenyl)methyl]piperidin-4-yl]methyl]-2-methyl-3-phenylpropanamide;dihydrochloride
CID 119865519
(2R)-2-hydroxy-N-[2-(4-methoxyphenyl)ethyl]propanamide
CID 175743514
[2-[2-(4-methoxyphenyl)ethylamino]-2-oxoethyl] 3,3-diphenylpropanoate
CID 8752538

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[2-(4-methoxyphenyl)ethyl]-2-methyl-3-phenylpropanamide?
The IUPAC name of 3-amino-N-[2-(4-methoxyphenyl)ethyl]-2-methyl-3-phenylpropanamide (CID 119673161) is 3-amino-N-[2-(4-methoxyphenyl)ethyl]-2-methyl-3-phenylpropanamide.
What is the SMILES notation for 3-amino-N-[2-(4-methoxyphenyl)ethyl]-2-methyl-3-phenylpropanamide?
The canonical SMILES for 3-amino-N-[2-(4-methoxyphenyl)ethyl]-2-methyl-3-phenylpropanamide is COc1ccc(CCNC(=O)C(C)C(N)c2ccccc2)cc1.
What is the InChIKey of 3-amino-N-[2-(4-methoxyphenyl)ethyl]-2-methyl-3-phenylpropanamide?
The InChIKey is BTEZCZUKAOSSFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O2/c1-14(18(20)16-6-4-3-5-7-16)19(22)21-13-12-15-8-10-17(23-2)11-9-15/h3-11,14,18H,12-13,20H2,1-2H3,(H,21,22).
What are the key properties of 3-amino-N-[2-(4-methoxyphenyl)ethyl]-2-methyl-3-phenylpropanamide?
3-amino-N-[2-(4-methoxyphenyl)ethyl]-2-methyl-3-phenylpropanamide has a molecular weight of 312.41 g/mol, XLogP of 2.69, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[2-(4-methoxyphenyl)ethyl]-2-methyl-3-phenylpropanamide is sourced from PubChem (CID 119673161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).