N-(3-amino-4-methoxyphenyl)-2-(3,4-dimethoxyphenyl)-2-methylpropanamide;hydrochloride

C19H25ClN2O4 — CID 119419316

IUPACN-(3-amino-4-methoxyphenyl)-2-(3,4-dimethoxyphenyl)-2-methylpropanamide;hydrochloride
SMILESCOc1ccc(NC(=O)C(C)(C)c2ccc(OC)c(OC)c2)cc1N.Cl
InChIInChI=1S/C19H24N2O4.ClH/c1-19(2,12-6-8-16(24-4)17(10-12)25-5)18(22)21-13-7-9-15(23-3)14(20)11-13;/h6-11H,20H2,1-5H3,(H,21,22);1H
InChIKeyVWMGBHFYBNIMRG-UHFFFAOYSA-N
MW380.87 g/mol
LogP3.63
Rot. Bonds6

About N-(3-amino-4-methoxyphenyl)-2-(3,4-dimethoxyphenyl)-2-methylpropanamide;hydrochloride

N-(3-amino-4-methoxyphenyl)-2-(3,4-dimethoxyphenyl)-2-methylpropanamide;hydrochloride (PubChem CID 119419316) has the molecular formula C19H25ClN2O4 and a molecular weight of 380.87 g/mol. Its IUPAC name is N-(3-amino-4-methoxyphenyl)-2-(3,4-dimethoxyphenyl)-2-methylpropanamide;hydrochloride.

Molecular Properties

Compound NameN-(3-amino-4-methoxyphenyl)-2-(3,4-dimethoxyphenyl)-2-methylpropanamide;hydrochloride
PubChem CID119419316
Molecular FormulaC19H25ClN2O4
Molecular Weight380.87 g/mol
Exact Mass380.15
IUPAC NameN-(3-amino-4-methoxyphenyl)-2-(3,4-dimethoxyphenyl)-2-methylpropanamide;hydrochloride
SMILESCOc1ccc(NC(=O)C(C)(C)c2ccc(OC)c(OC)c2)cc1N.Cl
InChIInChI=1S/C19H24N2O4.ClH/c1-19(2,12-6-8-16(24-4)17(10-12)25-5)18(22)21-13-7-9-15(23-3)14(20)11-13;/h6-11H,20H2,1-5H3,(H,21,22);1H
InChIKeyVWMGBHFYBNIMRG-UHFFFAOYSA-N
XLogP3.63
TPSA82.81 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.87
LogP ≤ 53.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

N-(3-amino-4-methoxyphenyl)-2-(3,4-dimethoxyphenyl)-2-methylpropanamide
CID 119419317
N-(4-chlorophenyl)-2-(3,4-dimethoxyphenyl)-2-methylpropanamide
CID 110438694
N-(3-amino-4-methoxyphenyl)-2-methyl-2-methylsulfonylpropanamide;hydrochloride
CID 119419084
N-(3-amino-4-methoxyphenyl)-4-tert-butylbenzamide
CID 18524942
2-(4-aminophenyl)-N-(3-chloro-4-methoxyphenyl)-2-methylpropanamide
CID 110451563
N-(3-amino-4-methoxyphenyl)-2,2,3,3-tetrafluoropropanamide;hydrochloride
CID 119419546
2-(3,4-dimethoxyphenyl)-N-(2-methoxy-5-methylphenyl)-2-methylpropanamide
CID 110438702
N-(2-aminoethyl)-2-(3,4-dimethoxyphenyl)-2-methylpropanamide;hydrochloride
CID 119382877
2-(3-amino-4-methoxyphenyl)-2-methylpropanoic acid
CID 141045302
N-(3-amino-4-methoxyphenyl)-2,2-dimethyl-3-phenylpropanamide
CID 119419521
N-(3-amino-4-methoxyphenyl)-2,3,3-trimethylbutanamide
CID 119419413
N-(3,4-dimethoxyphenyl)-2-(2-methoxyphenyl)-2-methylpropanamide
CID 110438838

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-4-methoxyphenyl)-2-(3,4-dimethoxyphenyl)-2-methylpropanamide;hydrochloride?
The IUPAC name of N-(3-amino-4-methoxyphenyl)-2-(3,4-dimethoxyphenyl)-2-methylpropanamide;hydrochloride (CID 119419316) is N-(3-amino-4-methoxyphenyl)-2-(3,4-dimethoxyphenyl)-2-methylpropanamide;hydrochloride.
What is the SMILES notation for N-(3-amino-4-methoxyphenyl)-2-(3,4-dimethoxyphenyl)-2-methylpropanamide;hydrochloride?
The canonical SMILES for N-(3-amino-4-methoxyphenyl)-2-(3,4-dimethoxyphenyl)-2-methylpropanamide;hydrochloride is COc1ccc(NC(=O)C(C)(C)c2ccc(OC)c(OC)c2)cc1N.Cl.
What is the InChIKey of N-(3-amino-4-methoxyphenyl)-2-(3,4-dimethoxyphenyl)-2-methylpropanamide;hydrochloride?
The InChIKey is VWMGBHFYBNIMRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O4.ClH/c1-19(2,12-6-8-16(24-4)17(10-12)25-5)18(22)21-13-7-9-15(23-3)14(20)11-13;/h6-11H,20H2,1-5H3,(H,21,22);1H.
What are the key properties of N-(3-amino-4-methoxyphenyl)-2-(3,4-dimethoxyphenyl)-2-methylpropanamide;hydrochloride?
N-(3-amino-4-methoxyphenyl)-2-(3,4-dimethoxyphenyl)-2-methylpropanamide;hydrochloride has a molecular weight of 380.87 g/mol, XLogP of 3.63, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-4-methoxyphenyl)-2-(3,4-dimethoxyphenyl)-2-methylpropanamide;hydrochloride is sourced from PubChem (CID 119419316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).