2-amino-N-methyl-2-phenyl-N-(3,4,5-trimethoxyphenyl)propanamide;hydrochloride

C19H25ClN2O4 — CID 120593249

IUPAC2-amino-N-methyl-2-phenyl-N-(3,4,5-trimethoxyphenyl)propanamide;hydrochloride
SMILESCOc1cc(N(C)C(=O)C(C)(N)c2ccccc2)cc(OC)c1OC.Cl
InChIInChI=1S/C19H24N2O4.ClH/c1-19(20,13-9-7-6-8-10-13)18(22)21(2)14-11-15(23-3)17(25-5)16(12-14)24-4;/h6-12H,20H2,1-5H3;1H
InChIKeyAJLIIBWWSCTJDL-UHFFFAOYSA-N
MW380.87 g/mol
LogP2.97
Rot. Bonds6

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

2-amino-N-methyl-2-phenyl-N-(3,4,5-trimethoxyphenyl)propanamide;hydrochloride (PubChem CID 120593249) has the molecular formula C19H25ClN2O4 and a molecular weight of 380.87 g/mol. Its IUPAC name is 2-amino-N-methyl-2-phenyl-N-(3,4,5-trimethoxyphenyl)propanamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-methyl-2-phenyl-N-(3,4,5-trimethoxyphenyl)propanamide;hydrochloride
PubChem CID120593249
Molecular FormulaC19H25ClN2O4
Molecular Weight380.87 g/mol
Exact Mass380.15
IUPAC Name2-amino-N-methyl-2-phenyl-N-(3,4,5-trimethoxyphenyl)propanamide;hydrochloride
SMILESCOc1cc(N(C)C(=O)C(C)(N)c2ccccc2)cc(OC)c1OC.Cl
InChIInChI=1S/C19H24N2O4.ClH/c1-19(20,13-9-7-6-8-10-13)18(22)21(2)14-11-15(23-3)17(25-5)16(12-14)24-4;/h6-12H,20H2,1-5H3;1H
InChIKeyAJLIIBWWSCTJDL-UHFFFAOYSA-N
XLogP2.97
TPSA74.02 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.87
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(2S)-2-amino-N,3,3-trimethyl-N-(3,4,5-trimethoxyphenyl)butanamide;hydrochloride
CID 119802002
2-hydroxy-2-phenyl-2-(3,4,5-trimethoxyphenyl)acetic acid
CID 139609935
2-amino-N-[(5-bromo-2-methoxyphenyl)methyl]-N-methyl-2-phenylpropanamide
CID 120586900
2-amino-N-[(3-methoxy-4-methylsulfanylphenyl)methyl]-N-methyl-2-phenylpropanamide;hydrochloride
CID 120590856
[1-oxo-3-phenyl-1-(3,4,5-trimethoxy-N-methylanilino)propan-2-yl] carbamate
CID 174829596
2-amino-N-(3,3-dimethylbutan-2-yl)-N-methyl-2-phenylpropanamide
CID 62487543
methyl (2R)-2-amino-2-phenylpropanoate;hydrochloride
CID 141027321
2-amino-N-(3-methoxypropyl)-N-methyl-2-phenylpropanamide;hydrochloride
CID 120590580
3-amino-3,4-diphenyl-1-(3,4,5-trimethoxyphenyl)butan-1-one
CID 67619399
(4S)-4-(dimethylamino)-2,2-diphenyl-1-(3,4,5-trimethoxyphenyl)pentan-1-one
CID 154665977
2-amino-N-[(2-ethoxyphenyl)methyl]-N-methyl-2-phenylpropanamide;hydrochloride
CID 120589610
tert-butyl N-[(2S)-1-oxo-3-phenyl-1-(3,4,5-trimethoxy-N-methylanilino)propan-2-yl]carbamate
CID 118047704

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-methyl-2-phenyl-N-(3,4,5-trimethoxyphenyl)propanamide;hydrochloride?
The IUPAC name of 2-amino-N-methyl-2-phenyl-N-(3,4,5-trimethoxyphenyl)propanamide;hydrochloride (CID 120593249) is 2-amino-N-methyl-2-phenyl-N-(3,4,5-trimethoxyphenyl)propanamide;hydrochloride.
What is the SMILES notation for 2-amino-N-methyl-2-phenyl-N-(3,4,5-trimethoxyphenyl)propanamide;hydrochloride?
The canonical SMILES for 2-amino-N-methyl-2-phenyl-N-(3,4,5-trimethoxyphenyl)propanamide;hydrochloride is COc1cc(N(C)C(=O)C(C)(N)c2ccccc2)cc(OC)c1OC.Cl.
What is the InChIKey of 2-amino-N-methyl-2-phenyl-N-(3,4,5-trimethoxyphenyl)propanamide;hydrochloride?
The InChIKey is AJLIIBWWSCTJDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O4.ClH/c1-19(20,13-9-7-6-8-10-13)18(22)21(2)14-11-15(23-3)17(25-5)16(12-14)24-4;/h6-12H,20H2,1-5H3;1H.
What are the key properties of 2-amino-N-methyl-2-phenyl-N-(3,4,5-trimethoxyphenyl)propanamide;hydrochloride?
2-amino-N-methyl-2-phenyl-N-(3,4,5-trimethoxyphenyl)propanamide;hydrochloride has a molecular weight of 380.87 g/mol, XLogP of 2.97, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-methyl-2-phenyl-N-(3,4,5-trimethoxyphenyl)propanamide;hydrochloride is sourced from PubChem (CID 120593249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).