2-amino-N-(3-anilinopropyl)-2-(4-methylphenyl)acetamide;dihydrochloride

C18H25Cl2N3O — CID 120669990

IUPAC2-amino-N-(3-anilinopropyl)-2-(4-methylphenyl)acetamide;dihydrochloride
SMILESCc1ccc(C(N)C(=O)NCCCNc2ccccc2)cc1.Cl.Cl
InChIInChI=1S/C18H23N3O.2ClH/c1-14-8-10-15(11-9-14)17(19)18(22)21-13-5-12-20-16-6-3-2-4-7-16;;/h2-4,6-11,17,20H,5,12-13,19H2,1H3,(H,21,22);2*1H
InChIKeyIZFSYMHPIVBOEQ-UHFFFAOYSA-N
MW370.32 g/mol
LogP3.46
Rot. Bonds7

About 2-amino-N-(3-anilinopropyl)-2-(4-methylphenyl)acetamide;dihydrochloride

2-amino-N-(3-anilinopropyl)-2-(4-methylphenyl)acetamide;dihydrochloride (PubChem CID 120669990) has the molecular formula C18H25Cl2N3O and a molecular weight of 370.32 g/mol. Its IUPAC name is 2-amino-N-(3-anilinopropyl)-2-(4-methylphenyl)acetamide;dihydrochloride.

Molecular Properties

Compound Name2-amino-N-(3-anilinopropyl)-2-(4-methylphenyl)acetamide;dihydrochloride
PubChem CID120669990
Molecular FormulaC18H25Cl2N3O
Molecular Weight370.32 g/mol
Exact Mass369.14
IUPAC Name2-amino-N-(3-anilinopropyl)-2-(4-methylphenyl)acetamide;dihydrochloride
SMILESCc1ccc(C(N)C(=O)NCCCNc2ccccc2)cc1.Cl.Cl
InChIInChI=1S/C18H23N3O.2ClH/c1-14-8-10-15(11-9-14)17(19)18(22)21-13-5-12-20-16-6-3-2-4-7-16;;/h2-4,6-11,17,20H,5,12-13,19H2,1H3,(H,21,22);2*1H
InChIKeyIZFSYMHPIVBOEQ-UHFFFAOYSA-N
XLogP3.46
TPSA67.15 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.32
LogP ≤ 53.46
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-amino-N-(3-anilinopropyl)-2-(4-methylphenyl)acetamide;dihydrochloride 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-2-(4-methylphenyl)-N-[4-(pyridin-2-ylamino)butyl]acetamide;dihydrochloride
CID 120670104
2-amino-N-[3-(benzenesulfonyl)propyl]-2-(4-methylphenyl)acetamide;hydrochloride
CID 120667950
2-amino-2-(4-methylphenyl)-N-[3-(1-phenylethoxy)propyl]acetamide
CID 120666814
2-amino-2-(4-methylphenyl)-N-[3-(2-phenylethoxy)propyl]acetamide
CID 120667657
2-amino-N-[2-(2-methylphenoxy)ethyl]-2-(4-methylphenyl)acetamide;hydrochloride
CID 120667716
2-amino-N-(2-aminoethyl)-2-(4-methylphenyl)acetamide
CID 106151018
2-amino-N-[3-(4-methyl-2-nitroanilino)propyl]-2-phenylacetamide;hydrochloride
CID 119332473
2-amino-N-[3-(dipropylamino)propyl]-2-(4-methylphenyl)acetamide;dihydrochloride
CID 120669868
2-amino-N-(3-methoxypropyl)-2-phenylacetamide;hydrochloride
CID 119262550
2-amino-2-(4-methylphenyl)-N-(6-methylsulfanylhexyl)acetamide
CID 106312957
2-amino-2-(4-methylphenyl)-N-(5-methylsulfanylpentyl)acetamide
CID 106312958
3-amino-N-(3-anilinopropyl)-3-phenylpropanamide;dihydrochloride
CID 119953482

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(3-anilinopropyl)-2-(4-methylphenyl)acetamide;dihydrochloride?
The IUPAC name of 2-amino-N-(3-anilinopropyl)-2-(4-methylphenyl)acetamide;dihydrochloride (CID 120669990) is 2-amino-N-(3-anilinopropyl)-2-(4-methylphenyl)acetamide;dihydrochloride.
What is the SMILES notation for 2-amino-N-(3-anilinopropyl)-2-(4-methylphenyl)acetamide;dihydrochloride?
The canonical SMILES for 2-amino-N-(3-anilinopropyl)-2-(4-methylphenyl)acetamide;dihydrochloride is Cc1ccc(C(N)C(=O)NCCCNc2ccccc2)cc1.Cl.Cl.
What is the InChIKey of 2-amino-N-(3-anilinopropyl)-2-(4-methylphenyl)acetamide;dihydrochloride?
The InChIKey is IZFSYMHPIVBOEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3O.2ClH/c1-14-8-10-15(11-9-14)17(19)18(22)21-13-5-12-20-16-6-3-2-4-7-16;;/h2-4,6-11,17,20H,5,12-13,19H2,1H3,(H,21,22);2*1H.
What are the key properties of 2-amino-N-(3-anilinopropyl)-2-(4-methylphenyl)acetamide;dihydrochloride?
2-amino-N-(3-anilinopropyl)-2-(4-methylphenyl)acetamide;dihydrochloride has a molecular weight of 370.32 g/mol, XLogP of 3.46, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(3-anilinopropyl)-2-(4-methylphenyl)acetamide;dihydrochloride is sourced from PubChem (CID 120669990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).