2-amino-N-[(2-chlorophenyl)-(2,4-dimethoxyphenyl)methyl]-3-methoxypropanamide;hydrochloride

C19H24Cl2N2O4 — CID 120991275

IUPAC2-amino-N-[(2-chlorophenyl)-(2,4-dimethoxyphenyl)methyl]-3-methoxypropanamide;hydrochloride
SMILESCOCC(N)C(=O)NC(c1ccccc1Cl)c1ccc(OC)cc1OC.Cl
InChIInChI=1S/C19H23ClN2O4.ClH/c1-24-11-16(21)19(23)22-18(13-6-4-5-7-15(13)20)14-9-8-12(25-2)10-17(14)26-3;/h4-10,16,18H,11,21H2,1-3H3,(H,22,23);1H
InChIKeyPDLKQCMDHGBFRV-UHFFFAOYSA-N
MW415.32 g/mol
LogP2.96
Rot. Bonds8

About 2-amino-N-[(2-chlorophenyl)-(2,4-dimethoxyphenyl)methyl]-3-methoxypropanamide;hydrochloride

2-amino-N-[(2-chlorophenyl)-(2,4-dimethoxyphenyl)methyl]-3-methoxypropanamide;hydrochloride (PubChem CID 120991275) has the molecular formula C19H24Cl2N2O4 and a molecular weight of 415.32 g/mol. Its IUPAC name is 2-amino-N-[(2-chlorophenyl)-(2,4-dimethoxyphenyl)methyl]-3-methoxypropanamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-[(2-chlorophenyl)-(2,4-dimethoxyphenyl)methyl]-3-methoxypropanamide;hydrochloride
PubChem CID120991275
Molecular FormulaC19H24Cl2N2O4
Molecular Weight415.32 g/mol
Exact Mass414.11
IUPAC Name2-amino-N-[(2-chlorophenyl)-(2,4-dimethoxyphenyl)methyl]-3-methoxypropanamide;hydrochloride
SMILESCOCC(N)C(=O)NC(c1ccccc1Cl)c1ccc(OC)cc1OC.Cl
InChIInChI=1S/C19H23ClN2O4.ClH/c1-24-11-16(21)19(23)22-18(13-6-4-5-7-15(13)20)14-9-8-12(25-2)10-17(14)26-3;/h4-10,16,18H,11,21H2,1-3H3,(H,22,23);1H
InChIKeyPDLKQCMDHGBFRV-UHFFFAOYSA-N
XLogP2.96
TPSA82.81 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500415.32
LogP ≤ 52.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-amino-N-[(2-chlorophenyl)-(2,4-dimethoxyphenyl)methyl]-3-methoxypropanamide;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

2-amino-N-[(2-chlorophenyl)-(2-methoxyphenyl)methyl]pentanamide
CID 119333887
2-amino-3-methoxy-N-[1-(2-methoxyphenyl)ethyl]propanamide
CID 81089691
4-amino-N-[(2-chlorophenyl)-(4-methoxy-2-methylphenyl)methyl]butanamide
CID 119331157
N-[(1S)-1-(2-chlorophenyl)ethyl]-2,4-dimethoxybenzamide
CID 26907594
N-[bis(2-methoxyphenyl)methyl]-2-(4-methoxyphenyl)propanamide
CID 175079399
2-amino-N-[1-(2,5-dichlorophenyl)ethyl]-3-methoxypropanamide
CID 120985367
(2R)-N-[bis(2-methoxyphenyl)methyl]-2-(3-methoxyphenyl)propanamide
CID 175077075
N-[(2-chlorophenyl)-(4-methoxy-2-methylphenyl)methyl]-4-(methylamino)butanamide
CID 119797021
N-[(2-chloro-4-methoxyphenyl)-(2-methoxyphenyl)methyl]ethanamine
CID 43562040
2-amino-N-[1-(2-bromophenyl)ethyl]-3-methoxypropanamide;hydrochloride
CID 120983408
(2-chlorophenyl)-(2,5-dimethoxyphenyl)methanamine
CID 43197194
N-[(3-chloro-2-pyridinyl)-(2,4-dimethoxyphenyl)methyl]ethanamine
CID 103444648

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[(2-chlorophenyl)-(2,4-dimethoxyphenyl)methyl]-3-methoxypropanamide;hydrochloride?
The IUPAC name of 2-amino-N-[(2-chlorophenyl)-(2,4-dimethoxyphenyl)methyl]-3-methoxypropanamide;hydrochloride (CID 120991275) is 2-amino-N-[(2-chlorophenyl)-(2,4-dimethoxyphenyl)methyl]-3-methoxypropanamide;hydrochloride.
What is the SMILES notation for 2-amino-N-[(2-chlorophenyl)-(2,4-dimethoxyphenyl)methyl]-3-methoxypropanamide;hydrochloride?
The canonical SMILES for 2-amino-N-[(2-chlorophenyl)-(2,4-dimethoxyphenyl)methyl]-3-methoxypropanamide;hydrochloride is COCC(N)C(=O)NC(c1ccccc1Cl)c1ccc(OC)cc1OC.Cl.
What is the InChIKey of 2-amino-N-[(2-chlorophenyl)-(2,4-dimethoxyphenyl)methyl]-3-methoxypropanamide;hydrochloride?
The InChIKey is PDLKQCMDHGBFRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23ClN2O4.ClH/c1-24-11-16(21)19(23)22-18(13-6-4-5-7-15(13)20)14-9-8-12(25-2)10-17(14)26-3;/h4-10,16,18H,11,21H2,1-3H3,(H,22,23);1H.
What are the key properties of 2-amino-N-[(2-chlorophenyl)-(2,4-dimethoxyphenyl)methyl]-3-methoxypropanamide;hydrochloride?
2-amino-N-[(2-chlorophenyl)-(2,4-dimethoxyphenyl)methyl]-3-methoxypropanamide;hydrochloride has a molecular weight of 415.32 g/mol, XLogP of 2.96, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[(2-chlorophenyl)-(2,4-dimethoxyphenyl)methyl]-3-methoxypropanamide;hydrochloride is sourced from PubChem (CID 120991275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).