2-amino-N-naphthalen-1-yl-N-[2-(4-phenylphenyl)ethyl]acetamide

C26H24N2O — CID 10452377

IUPAC2-amino-N-naphthalen-1-yl-N-[2-(4-phenylphenyl)ethyl]acetamide
SMILESNCC(=O)N(CCc1ccc(-c2ccccc2)cc1)c1cccc2ccccc12
InChIInChI=1S/C26H24N2O/c27-19-26(29)28(25-12-6-10-23-9-4-5-11-24(23)25)18-17-20-13-15-22(16-14-20)21-7-2-1-3-8-21/h1-16H,17-19,27H2
InChIKeyAGFLVGQQDGEZMC-UHFFFAOYSA-N
MW380.49 g/mol
LogP5.04
Rot. Bonds6

About 2-amino-N-naphthalen-1-yl-N-[2-(4-phenylphenyl)ethyl]acetamide

2-amino-N-naphthalen-1-yl-N-[2-(4-phenylphenyl)ethyl]acetamide (PubChem CID 10452377) has the molecular formula C26H24N2O and a molecular weight of 380.49 g/mol. Its IUPAC name is 2-amino-N-naphthalen-1-yl-N-[2-(4-phenylphenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-amino-N-naphthalen-1-yl-N-[2-(4-phenylphenyl)ethyl]acetamide
PubChem CID10452377
Molecular FormulaC26H24N2O
Molecular Weight380.49 g/mol
Exact Mass380.19
IUPAC Name2-amino-N-naphthalen-1-yl-N-[2-(4-phenylphenyl)ethyl]acetamide
SMILESNCC(=O)N(CCc1ccc(-c2ccccc2)cc1)c1cccc2ccccc12
InChIInChI=1S/C26H24N2O/c27-19-26(29)28(25-12-6-10-23-9-4-5-11-24(23)25)18-17-20-13-15-22(16-14-20)21-7-2-1-3-8-21/h1-16H,17-19,27H2
InChIKeyAGFLVGQQDGEZMC-UHFFFAOYSA-N
XLogP5.04
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500380.49
LogP ≤ 55.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-naphthalen-1-yl-N-[2-(4-phenylphenyl)ethyl]acetamide?
The IUPAC name of 2-amino-N-naphthalen-1-yl-N-[2-(4-phenylphenyl)ethyl]acetamide (CID 10452377) is 2-amino-N-naphthalen-1-yl-N-[2-(4-phenylphenyl)ethyl]acetamide.
What is the SMILES notation for 2-amino-N-naphthalen-1-yl-N-[2-(4-phenylphenyl)ethyl]acetamide?
The canonical SMILES for 2-amino-N-naphthalen-1-yl-N-[2-(4-phenylphenyl)ethyl]acetamide is NCC(=O)N(CCc1ccc(-c2ccccc2)cc1)c1cccc2ccccc12.
What is the InChIKey of 2-amino-N-naphthalen-1-yl-N-[2-(4-phenylphenyl)ethyl]acetamide?
The InChIKey is AGFLVGQQDGEZMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H24N2O/c27-19-26(29)28(25-12-6-10-23-9-4-5-11-24(23)25)18-17-20-13-15-22(16-14-20)21-7-2-1-3-8-21/h1-16H,17-19,27H2.
What are the key properties of 2-amino-N-naphthalen-1-yl-N-[2-(4-phenylphenyl)ethyl]acetamide?
2-amino-N-naphthalen-1-yl-N-[2-(4-phenylphenyl)ethyl]acetamide has a molecular weight of 380.49 g/mol, XLogP of 5.04, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-naphthalen-1-yl-N-[2-(4-phenylphenyl)ethyl]acetamide is sourced from PubChem (CID 10452377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).