N-hydroxy-N-[6-(2-phenylethyl)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide

C20H23NO2 — CID 57297628

IUPACN-hydroxy-N-[6-(2-phenylethyl)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide
SMILESCC(=O)N(O)C1CCCc2cc(CCc3ccccc3)ccc21
InChIInChI=1S/C20H23NO2/c1-15(22)21(23)20-9-5-8-18-14-17(12-13-19(18)20)11-10-16-6-3-2-4-7-16/h2-4,6-7,12-14,20,23H,5,8-11H2,1H3
InChIKeyYECQETKDBOOLCC-UHFFFAOYSA-N
MW309.41 g/mol
LogP4.09
Rot. Bonds4

About N-hydroxy-N-[6-(2-phenylethyl)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide

N-hydroxy-N-[6-(2-phenylethyl)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide (PubChem CID 57297628) has the molecular formula C20H23NO2 and a molecular weight of 309.41 g/mol. Its IUPAC name is N-hydroxy-N-[6-(2-phenylethyl)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide.

Molecular Properties

Compound NameN-hydroxy-N-[6-(2-phenylethyl)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide
PubChem CID57297628
Molecular FormulaC20H23NO2
Molecular Weight309.41 g/mol
Exact Mass309.17
IUPAC NameN-hydroxy-N-[6-(2-phenylethyl)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide
SMILESCC(=O)N(O)C1CCCc2cc(CCc3ccccc3)ccc21
InChIInChI=1S/C20H23NO2/c1-15(22)21(23)20-9-5-8-18-14-17(12-13-19(18)20)11-10-16-6-3-2-4-7-16/h2-4,6-7,12-14,20,23H,5,8-11H2,1H3
InChIKeyYECQETKDBOOLCC-UHFFFAOYSA-N
XLogP4.09
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.41
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N-hydroxy-N-[6-(2-phenylethyl)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-N-[6-(2-phenylethyl)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide?
The IUPAC name of N-hydroxy-N-[6-(2-phenylethyl)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide (CID 57297628) is N-hydroxy-N-[6-(2-phenylethyl)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide.
What is the SMILES notation for N-hydroxy-N-[6-(2-phenylethyl)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide?
The canonical SMILES for N-hydroxy-N-[6-(2-phenylethyl)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide is CC(=O)N(O)C1CCCc2cc(CCc3ccccc3)ccc21.
What is the InChIKey of N-hydroxy-N-[6-(2-phenylethyl)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide?
The InChIKey is YECQETKDBOOLCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23NO2/c1-15(22)21(23)20-9-5-8-18-14-17(12-13-19(18)20)11-10-16-6-3-2-4-7-16/h2-4,6-7,12-14,20,23H,5,8-11H2,1H3.
What are the key properties of N-hydroxy-N-[6-(2-phenylethyl)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide?
N-hydroxy-N-[6-(2-phenylethyl)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide has a molecular weight of 309.41 g/mol, XLogP of 4.09, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-N-[6-(2-phenylethyl)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide is sourced from PubChem (CID 57297628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).