2-(2-aminoethoxy)-N-(5-hydroxynaphthalen-1-yl)acetamide

C14H16N2O3 — CID 79473649

IUPAC2-(2-aminoethoxy)-N-(5-hydroxynaphthalen-1-yl)acetamide
SMILESNCCOCC(=O)Nc1cccc2c(O)cccc12
InChIInChI=1S/C14H16N2O3/c15-7-8-19-9-14(18)16-12-5-1-4-11-10(12)3-2-6-13(11)17/h1-6,17H,7-9,15H2,(H,16,18)
InChIKeyGNEXSUHFDSFRSK-UHFFFAOYSA-N
MW260.29 g/mol
LogP1.46
Rot. Bonds5

About 2-(2-aminoethoxy)-N-(5-hydroxynaphthalen-1-yl)acetamide

2-(2-aminoethoxy)-N-(5-hydroxynaphthalen-1-yl)acetamide (PubChem CID 79473649) has the molecular formula C14H16N2O3 and a molecular weight of 260.29 g/mol. Its IUPAC name is 2-(2-aminoethoxy)-N-(5-hydroxynaphthalen-1-yl)acetamide.

Molecular Properties

Compound Name2-(2-aminoethoxy)-N-(5-hydroxynaphthalen-1-yl)acetamide
PubChem CID79473649
Molecular FormulaC14H16N2O3
Molecular Weight260.29 g/mol
Exact Mass260.12
IUPAC Name2-(2-aminoethoxy)-N-(5-hydroxynaphthalen-1-yl)acetamide
SMILESNCCOCC(=O)Nc1cccc2c(O)cccc12
InChIInChI=1S/C14H16N2O3/c15-7-8-19-9-14(18)16-12-5-1-4-11-10(12)3-2-6-13(11)17/h1-6,17H,7-9,15H2,(H,16,18)
InChIKeyGNEXSUHFDSFRSK-UHFFFAOYSA-N
XLogP1.46
TPSA84.58 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.29
LogP ≤ 51.46
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(2-aminoethoxy)-N-(5-hydroxynaphthalen-1-yl)acetamide?
The IUPAC name of 2-(2-aminoethoxy)-N-(5-hydroxynaphthalen-1-yl)acetamide (CID 79473649) is 2-(2-aminoethoxy)-N-(5-hydroxynaphthalen-1-yl)acetamide.
What is the SMILES notation for 2-(2-aminoethoxy)-N-(5-hydroxynaphthalen-1-yl)acetamide?
The canonical SMILES for 2-(2-aminoethoxy)-N-(5-hydroxynaphthalen-1-yl)acetamide is NCCOCC(=O)Nc1cccc2c(O)cccc12.
What is the InChIKey of 2-(2-aminoethoxy)-N-(5-hydroxynaphthalen-1-yl)acetamide?
The InChIKey is GNEXSUHFDSFRSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O3/c15-7-8-19-9-14(18)16-12-5-1-4-11-10(12)3-2-6-13(11)17/h1-6,17H,7-9,15H2,(H,16,18).
What are the key properties of 2-(2-aminoethoxy)-N-(5-hydroxynaphthalen-1-yl)acetamide?
2-(2-aminoethoxy)-N-(5-hydroxynaphthalen-1-yl)acetamide has a molecular weight of 260.29 g/mol, XLogP of 1.46, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminoethoxy)-N-(5-hydroxynaphthalen-1-yl)acetamide is sourced from PubChem (CID 79473649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).