1-[6-[ethyl(2-hydroxyethyl)amino]naphthalen-2-yl]ethanone

C16H19NO2 — CID 15374809

IUPAC1-[6-[ethyl(2-hydroxyethyl)amino]naphthalen-2-yl]ethanone
SMILESCCN(CCO)c1ccc2cc(C(C)=O)ccc2c1
InChIInChI=1S/C16H19NO2/c1-3-17(8-9-18)16-7-6-14-10-13(12(2)19)4-5-15(14)11-16/h4-7,10-11,18H,3,8-9H2,1-2H3
InChIKeyLEFIGYYCTMBGKW-UHFFFAOYSA-N
MW257.33 g/mol
LogP2.86
Rot. Bonds5

About 1-[6-[ethyl(2-hydroxyethyl)amino]naphthalen-2-yl]ethanone

1-[6-[ethyl(2-hydroxyethyl)amino]naphthalen-2-yl]ethanone (PubChem CID 15374809) has the molecular formula C16H19NO2 and a molecular weight of 257.33 g/mol. Its IUPAC name is 1-[6-[ethyl(2-hydroxyethyl)amino]naphthalen-2-yl]ethanone.

Molecular Properties

Compound Name1-[6-[ethyl(2-hydroxyethyl)amino]naphthalen-2-yl]ethanone
PubChem CID15374809
Molecular FormulaC16H19NO2
Molecular Weight257.33 g/mol
Exact Mass257.14
IUPAC Name1-[6-[ethyl(2-hydroxyethyl)amino]naphthalen-2-yl]ethanone
SMILESCCN(CCO)c1ccc2cc(C(C)=O)ccc2c1
InChIInChI=1S/C16H19NO2/c1-3-17(8-9-18)16-7-6-14-10-13(12(2)19)4-5-15(14)11-16/h4-7,10-11,18H,3,8-9H2,1-2H3
InChIKeyLEFIGYYCTMBGKW-UHFFFAOYSA-N
XLogP2.86
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.33
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-[6-[ethyl(2-hydroxyethyl)amino]naphthalen-2-yl]ethanone 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 1-[6-[ethyl(2-hydroxyethyl)amino]naphthalen-2-yl]ethanone?
The IUPAC name of 1-[6-[ethyl(2-hydroxyethyl)amino]naphthalen-2-yl]ethanone (CID 15374809) is 1-[6-[ethyl(2-hydroxyethyl)amino]naphthalen-2-yl]ethanone.
What is the SMILES notation for 1-[6-[ethyl(2-hydroxyethyl)amino]naphthalen-2-yl]ethanone?
The canonical SMILES for 1-[6-[ethyl(2-hydroxyethyl)amino]naphthalen-2-yl]ethanone is CCN(CCO)c1ccc2cc(C(C)=O)ccc2c1.
What is the InChIKey of 1-[6-[ethyl(2-hydroxyethyl)amino]naphthalen-2-yl]ethanone?
The InChIKey is LEFIGYYCTMBGKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO2/c1-3-17(8-9-18)16-7-6-14-10-13(12(2)19)4-5-15(14)11-16/h4-7,10-11,18H,3,8-9H2,1-2H3.
What are the key properties of 1-[6-[ethyl(2-hydroxyethyl)amino]naphthalen-2-yl]ethanone?
1-[6-[ethyl(2-hydroxyethyl)amino]naphthalen-2-yl]ethanone has a molecular weight of 257.33 g/mol, XLogP of 2.86, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-[ethyl(2-hydroxyethyl)amino]naphthalen-2-yl]ethanone is sourced from PubChem (CID 15374809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).