N-(2-amino-5-chlorophenyl)-2-phenylacetamide

C14H13ClN2O — CID 18071244

IUPACN-(2-amino-5-chlorophenyl)-2-phenylacetamide
SMILESNc1ccc(Cl)cc1NC(=O)Cc1ccccc1
InChIInChI=1S/C14H13ClN2O/c15-11-6-7-12(16)13(9-11)17-14(18)8-10-4-2-1-3-5-10/h1-7,9H,8,16H2,(H,17,18)
InChIKeyMIJPHSPLEOSZFN-UHFFFAOYSA-N
MW260.72 g/mol
LogP3.10
Rot. Bonds3

About N-(2-amino-5-chlorophenyl)-2-phenylacetamide

N-(2-amino-5-chlorophenyl)-2-phenylacetamide (PubChem CID 18071244) has the molecular formula C14H13ClN2O and a molecular weight of 260.72 g/mol. Its IUPAC name is N-(2-amino-5-chlorophenyl)-2-phenylacetamide.

Molecular Properties

Compound NameN-(2-amino-5-chlorophenyl)-2-phenylacetamide
PubChem CID18071244
Molecular FormulaC14H13ClN2O
Molecular Weight260.72 g/mol
Exact Mass260.07
IUPAC NameN-(2-amino-5-chlorophenyl)-2-phenylacetamide
SMILESNc1ccc(Cl)cc1NC(=O)Cc1ccccc1
InChIInChI=1S/C14H13ClN2O/c15-11-6-7-12(16)13(9-11)17-14(18)8-10-4-2-1-3-5-10/h1-7,9H,8,16H2,(H,17,18)
InChIKeyMIJPHSPLEOSZFN-UHFFFAOYSA-N
XLogP3.10
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.72
LogP ≤ 53.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(2-amino-5-chlorophenyl)-2-phenylacetamide?
The IUPAC name of N-(2-amino-5-chlorophenyl)-2-phenylacetamide (CID 18071244) is N-(2-amino-5-chlorophenyl)-2-phenylacetamide.
What is the SMILES notation for N-(2-amino-5-chlorophenyl)-2-phenylacetamide?
The canonical SMILES for N-(2-amino-5-chlorophenyl)-2-phenylacetamide is Nc1ccc(Cl)cc1NC(=O)Cc1ccccc1.
What is the InChIKey of N-(2-amino-5-chlorophenyl)-2-phenylacetamide?
The InChIKey is MIJPHSPLEOSZFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13ClN2O/c15-11-6-7-12(16)13(9-11)17-14(18)8-10-4-2-1-3-5-10/h1-7,9H,8,16H2,(H,17,18).
What are the key properties of N-(2-amino-5-chlorophenyl)-2-phenylacetamide?
N-(2-amino-5-chlorophenyl)-2-phenylacetamide has a molecular weight of 260.72 g/mol, XLogP of 3.10, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-5-chlorophenyl)-2-phenylacetamide is sourced from PubChem (CID 18071244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).