N-[2-(3-chlorophenyl)ethyl]-2-[(2-methylphenyl)methylamino]acetamide

C18H21ClN2O — CID 108996547

IUPACN-[2-(3-chlorophenyl)ethyl]-2-[(2-methylphenyl)methylamino]acetamide
SMILESCc1ccccc1CNCC(=O)NCCc1cccc(Cl)c1
InChIInChI=1S/C18H21ClN2O/c1-14-5-2-3-7-16(14)12-20-13-18(22)21-10-9-15-6-4-8-17(19)11-15/h2-8,11,20H,9-10,12-13H2,1H3,(H,21,22)
InChIKeyBDDIIHXYFVPQKM-UHFFFAOYSA-N
MW316.83 g/mol
LogP3.10
Rot. Bonds7

About N-[2-(3-chlorophenyl)ethyl]-2-[(2-methylphenyl)methylamino]acetamide

N-[2-(3-chlorophenyl)ethyl]-2-[(2-methylphenyl)methylamino]acetamide (PubChem CID 108996547) has the molecular formula C18H21ClN2O and a molecular weight of 316.83 g/mol. Its IUPAC name is N-[2-(3-chlorophenyl)ethyl]-2-[(2-methylphenyl)methylamino]acetamide.

Molecular Properties

Compound NameN-[2-(3-chlorophenyl)ethyl]-2-[(2-methylphenyl)methylamino]acetamide
PubChem CID108996547
Molecular FormulaC18H21ClN2O
Molecular Weight316.83 g/mol
Exact Mass316.13
IUPAC NameN-[2-(3-chlorophenyl)ethyl]-2-[(2-methylphenyl)methylamino]acetamide
SMILESCc1ccccc1CNCC(=O)NCCc1cccc(Cl)c1
InChIInChI=1S/C18H21ClN2O/c1-14-5-2-3-7-16(14)12-20-13-18(22)21-10-9-15-6-4-8-17(19)11-15/h2-8,11,20H,9-10,12-13H2,1H3,(H,21,22)
InChIKeyBDDIIHXYFVPQKM-UHFFFAOYSA-N
XLogP3.10
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.83
LogP ≤ 53.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-[2-(3-chlorophenyl)ethyl]-2-[(2-methylphenyl)methylamino]acetamide 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-(benzylamino)-N-[2-(3-chlorophenyl)ethyl]acetamide
CID 108996409
N-[2-(3-chlorophenyl)ethyl]-2-(2,6-dimethylanilino)acetamide
CID 32908644
N-[2-(3-chlorophenyl)ethyl]-2-[2-(4-chlorophenyl)ethylamino]acetamide
CID 109002830
N-[2-(3-chlorophenyl)ethyl]-2-(3,5-dimethylanilino)acetamide
CID 109006812
N-[2-(3-chlorophenyl)ethyl]-2-methylpropanamide
CID 4249207
2-[2-(aminomethyl)phenyl]-N-[2-(3-chlorophenyl)ethyl]acetamide
CID 81313061
N-[(2-methylphenyl)methyl]-2-[(2-methylphenyl)methylamino]acetamide
CID 108996489
N-[2-(3-chlorophenyl)ethyl]-2-(3,5-dichloroanilino)acetamide
CID 109006882
2-[2-(3-chlorophenyl)ethylamino]-N-[(3-methylphenyl)methyl]acetamide
CID 108996919
N-[2-(3-chlorophenyl)ethyl]-2-[2-(2,4-dichlorophenyl)ethylamino]acetamide
CID 109006805
N-benzyl-2-[(4-chloro-2-methylphenyl)methylamino]acetamide
CID 104853952
methyl N-[2-[2-(3-chlorophenyl)ethylamino]-2-oxoethyl]carbamate
CID 112995851

Frequently Asked Questions

What is the IUPAC name of N-[2-(3-chlorophenyl)ethyl]-2-[(2-methylphenyl)methylamino]acetamide?
The IUPAC name of N-[2-(3-chlorophenyl)ethyl]-2-[(2-methylphenyl)methylamino]acetamide (CID 108996547) is N-[2-(3-chlorophenyl)ethyl]-2-[(2-methylphenyl)methylamino]acetamide.
What is the SMILES notation for N-[2-(3-chlorophenyl)ethyl]-2-[(2-methylphenyl)methylamino]acetamide?
The canonical SMILES for N-[2-(3-chlorophenyl)ethyl]-2-[(2-methylphenyl)methylamino]acetamide is Cc1ccccc1CNCC(=O)NCCc1cccc(Cl)c1.
What is the InChIKey of N-[2-(3-chlorophenyl)ethyl]-2-[(2-methylphenyl)methylamino]acetamide?
The InChIKey is BDDIIHXYFVPQKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21ClN2O/c1-14-5-2-3-7-16(14)12-20-13-18(22)21-10-9-15-6-4-8-17(19)11-15/h2-8,11,20H,9-10,12-13H2,1H3,(H,21,22).
What are the key properties of N-[2-(3-chlorophenyl)ethyl]-2-[(2-methylphenyl)methylamino]acetamide?
N-[2-(3-chlorophenyl)ethyl]-2-[(2-methylphenyl)methylamino]acetamide has a molecular weight of 316.83 g/mol, XLogP of 3.10, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-chlorophenyl)ethyl]-2-[(2-methylphenyl)methylamino]acetamide is sourced from PubChem (CID 108996547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).