2-naphthalen-1-ylacetamide

C12H11NO — CID 6861

IUPAC2-naphthalen-1-ylacetamide
SMILESNC(=O)Cc1cccc2ccccc12
InChIInChI=1S/C12H11NO/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H2,13,14)
InChIKeyXFNJVKMNNVCYEK-UHFFFAOYSA-N
MW185.23 g/mol
LogP1.87
Rot. Bonds2

About 2-naphthalen-1-ylacetamide

2-naphthalen-1-ylacetamide (PubChem CID 6861) has the molecular formula C12H11NO and a molecular weight of 185.23 g/mol. Its IUPAC name is 2-naphthalen-1-ylacetamide.

Molecular Properties

Compound Name2-naphthalen-1-ylacetamide
PubChem CID6861
Molecular FormulaC12H11NO
Molecular Weight185.23 g/mol
Exact Mass185.08
IUPAC Name2-naphthalen-1-ylacetamide
SMILESNC(=O)Cc1cccc2ccccc12
InChIInChI=1S/C12H11NO/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H2,13,14)
InChIKeyXFNJVKMNNVCYEK-UHFFFAOYSA-N
XLogP1.87
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.23
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-naphthalen-1-ylacetamide?
The IUPAC name of 2-naphthalen-1-ylacetamide (CID 6861) is 2-naphthalen-1-ylacetamide.
What is the SMILES notation for 2-naphthalen-1-ylacetamide?
The canonical SMILES for 2-naphthalen-1-ylacetamide is NC(=O)Cc1cccc2ccccc12.
What is the InChIKey of 2-naphthalen-1-ylacetamide?
The InChIKey is XFNJVKMNNVCYEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11NO/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H2,13,14).
What are the key properties of 2-naphthalen-1-ylacetamide?
2-naphthalen-1-ylacetamide has a molecular weight of 185.23 g/mol, XLogP of 1.87, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-naphthalen-1-ylacetamide is sourced from PubChem (CID 6861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).