2-(2-aminophenyl)-N-benzyl-N-phenylacetamide

C21H20N2O — CID 28712694

IUPAC2-(2-aminophenyl)-N-benzyl-N-phenylacetamide
SMILESNc1ccccc1CC(=O)N(Cc1ccccc1)c1ccccc1
InChIInChI=1S/C21H20N2O/c22-20-14-8-7-11-18(20)15-21(24)23(19-12-5-2-6-13-19)16-17-9-3-1-4-10-17/h1-14H,15-16,22H2
InChIKeyGCANAASUYZAWGD-UHFFFAOYSA-N
MW316.40 g/mol
LogP4.04
Rot. Bonds5

About 2-(2-aminophenyl)-N-benzyl-N-phenylacetamide

2-(2-aminophenyl)-N-benzyl-N-phenylacetamide (PubChem CID 28712694) has the molecular formula C21H20N2O and a molecular weight of 316.40 g/mol. Its IUPAC name is 2-(2-aminophenyl)-N-benzyl-N-phenylacetamide.

Molecular Properties

Compound Name2-(2-aminophenyl)-N-benzyl-N-phenylacetamide
PubChem CID28712694
Molecular FormulaC21H20N2O
Molecular Weight316.40 g/mol
Exact Mass316.16
IUPAC Name2-(2-aminophenyl)-N-benzyl-N-phenylacetamide
SMILESNc1ccccc1CC(=O)N(Cc1ccccc1)c1ccccc1
InChIInChI=1S/C21H20N2O/c22-20-14-8-7-11-18(20)15-21(24)23(19-12-5-2-6-13-19)16-17-9-3-1-4-10-17/h1-14H,15-16,22H2
InChIKeyGCANAASUYZAWGD-UHFFFAOYSA-N
XLogP4.04
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.40
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-(2-aminophenyl)-N,N-diphenylacetamide
CID 156705003
2-(2-aminophenyl)sulfanyl-N-benzyl-N-phenylacetamide
CID 858973
N-benzyl-2-(4-bromophenyl)-N-phenylacetamide
CID 18281131
N-benzyl-4-hydroxy-N-phenylbutanamide
CID 79191710
N-benzyl-5-hydroxy-N-phenylpentanamide
CID 79194764
3-amino-N-benzyl-N-phenylbutanamide
CID 61260730
(4-aminophenyl)-benzylcarbamic acid
CID 69046621
3-(2-aminophenyl)-N-ethyl-N-phenylpropanamide
CID 28713899
N-[3-(N-benzylanilino)-3-oxopropyl]-2,2-dimethylpropanamide
CID 24630749
2-(2-aminoethoxy)-N-benzyl-N-phenylacetamide
CID 79480179
2-(2-aminophenyl)-N,N-dimethylacetamide;hydrochloride
CID 141352115
1-(4-aminophenyl)-1-benzylurea
CID 154248103

Frequently Asked Questions

What is the IUPAC name of 2-(2-aminophenyl)-N-benzyl-N-phenylacetamide?
The IUPAC name of 2-(2-aminophenyl)-N-benzyl-N-phenylacetamide (CID 28712694) is 2-(2-aminophenyl)-N-benzyl-N-phenylacetamide.
What is the SMILES notation for 2-(2-aminophenyl)-N-benzyl-N-phenylacetamide?
The canonical SMILES for 2-(2-aminophenyl)-N-benzyl-N-phenylacetamide is Nc1ccccc1CC(=O)N(Cc1ccccc1)c1ccccc1.
What is the InChIKey of 2-(2-aminophenyl)-N-benzyl-N-phenylacetamide?
The InChIKey is GCANAASUYZAWGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N2O/c22-20-14-8-7-11-18(20)15-21(24)23(19-12-5-2-6-13-19)16-17-9-3-1-4-10-17/h1-14H,15-16,22H2.
What are the key properties of 2-(2-aminophenyl)-N-benzyl-N-phenylacetamide?
2-(2-aminophenyl)-N-benzyl-N-phenylacetamide has a molecular weight of 316.40 g/mol, XLogP of 4.04, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminophenyl)-N-benzyl-N-phenylacetamide is sourced from PubChem (CID 28712694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).