2-amino-2-phenyl-N-[(3,4,5-trimethoxyphenyl)methyl]acetamide;hydrochloride

C18H23ClN2O4 — CID 119272323

IUPAC2-amino-2-phenyl-N-[(3,4,5-trimethoxyphenyl)methyl]acetamide;hydrochloride
SMILESCOc1cc(CNC(=O)C(N)c2ccccc2)cc(OC)c1OC.Cl
InChIInChI=1S/C18H22N2O4.ClH/c1-22-14-9-12(10-15(23-2)17(14)24-3)11-20-18(21)16(19)13-7-5-4-6-8-13;/h4-10,16H,11,19H2,1-3H3,(H,20,21);1H
InChIKeyHMMKCVHXSGCJEL-UHFFFAOYSA-N
MW366.85 g/mol
LogP2.45
Rot. Bonds7

About 2-amino-2-phenyl-N-[(3,4,5-trimethoxyphenyl)methyl]acetamide;hydrochloride

2-amino-2-phenyl-N-[(3,4,5-trimethoxyphenyl)methyl]acetamide;hydrochloride (PubChem CID 119272323) has the molecular formula C18H23ClN2O4 and a molecular weight of 366.85 g/mol. Its IUPAC name is 2-amino-2-phenyl-N-[(3,4,5-trimethoxyphenyl)methyl]acetamide;hydrochloride.

Molecular Properties

Compound Name2-amino-2-phenyl-N-[(3,4,5-trimethoxyphenyl)methyl]acetamide;hydrochloride
PubChem CID119272323
Molecular FormulaC18H23ClN2O4
Molecular Weight366.85 g/mol
Exact Mass366.13
IUPAC Name2-amino-2-phenyl-N-[(3,4,5-trimethoxyphenyl)methyl]acetamide;hydrochloride
SMILESCOc1cc(CNC(=O)C(N)c2ccccc2)cc(OC)c1OC.Cl
InChIInChI=1S/C18H22N2O4.ClH/c1-22-14-9-12(10-15(23-2)17(14)24-3)11-20-18(21)16(19)13-7-5-4-6-8-13;/h4-10,16H,11,19H2,1-3H3,(H,20,21);1H
InChIKeyHMMKCVHXSGCJEL-UHFFFAOYSA-N
XLogP2.45
TPSA82.81 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.85
LogP ≤ 52.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-amino-2-phenyl-N-[(3,4,5-trimethoxyphenyl)methyl]acetamide;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2S)-2-amino-3-phenyl-N-[(3,4,5-trimethoxyphenyl)methyl]propanamide;hydrochloride
CID 119272311
2-amino-N-[(3,4,5-trimethoxyphenyl)methyl]propanamide;hydrochloride
CID 119272316
(2R)-2-amino-N-[(3-bromo-4,5-dimethoxyphenyl)methyl]propanamide;hydrochloride
CID 119312695
2-amino-N-[(3-chloro-4-ethoxy-5-methoxyphenyl)methyl]-2-(4-methylphenyl)acetamide
CID 120667495
3-amino-N-[(3,4-dimethoxyphenyl)methyl]-3-phenylpropanamide;hydrochloride
CID 119948750
2-amino-2-phenyl-N-[2-(2,4,6-trimethoxyphenyl)ethyl]acetamide;hydrochloride
CID 119320830
(2S)-2-amino-4-methylsulfanyl-N-[(3,4,5-trimethoxyphenyl)methyl]butanamide;hydrochloride
CID 119272313
2-amino-N-[(3-bromo-4,5-dimethoxyphenyl)methyl]-3-methoxypropanamide;hydrochloride
CID 120988226
(2R)-2-amino-N-[(2-chloro-6-methoxyphenyl)methyl]-2-phenylacetamide
CID 103292472
1-phenyl-2-[(3,4,5-trimethoxyphenyl)methylamino]ethanol;hydrochloride
CID 17295818
(2R)-2-amino-N-[(4-hydroxyphenyl)methyl]-2-phenylacetamide
CID 96927089
3-amino-N-[(3-bromo-4,5-dimethoxyphenyl)methyl]-2-methylbutanamide
CID 120500013

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-phenyl-N-[(3,4,5-trimethoxyphenyl)methyl]acetamide;hydrochloride?
The IUPAC name of 2-amino-2-phenyl-N-[(3,4,5-trimethoxyphenyl)methyl]acetamide;hydrochloride (CID 119272323) is 2-amino-2-phenyl-N-[(3,4,5-trimethoxyphenyl)methyl]acetamide;hydrochloride.
What is the SMILES notation for 2-amino-2-phenyl-N-[(3,4,5-trimethoxyphenyl)methyl]acetamide;hydrochloride?
The canonical SMILES for 2-amino-2-phenyl-N-[(3,4,5-trimethoxyphenyl)methyl]acetamide;hydrochloride is COc1cc(CNC(=O)C(N)c2ccccc2)cc(OC)c1OC.Cl.
What is the InChIKey of 2-amino-2-phenyl-N-[(3,4,5-trimethoxyphenyl)methyl]acetamide;hydrochloride?
The InChIKey is HMMKCVHXSGCJEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O4.ClH/c1-22-14-9-12(10-15(23-2)17(14)24-3)11-20-18(21)16(19)13-7-5-4-6-8-13;/h4-10,16H,11,19H2,1-3H3,(H,20,21);1H.
What are the key properties of 2-amino-2-phenyl-N-[(3,4,5-trimethoxyphenyl)methyl]acetamide;hydrochloride?
2-amino-2-phenyl-N-[(3,4,5-trimethoxyphenyl)methyl]acetamide;hydrochloride has a molecular weight of 366.85 g/mol, XLogP of 2.45, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-phenyl-N-[(3,4,5-trimethoxyphenyl)methyl]acetamide;hydrochloride is sourced from PubChem (CID 119272323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).