2-[(2-hydroxy-2-naphthalen-2-ylethyl)amino]acetamide

C14H16N2O2 — CID 60899600

IUPAC2-[(2-hydroxy-2-naphthalen-2-ylethyl)amino]acetamide
SMILESNC(=O)CNCC(O)c1ccc2ccccc2c1
InChIInChI=1S/C14H16N2O2/c15-14(18)9-16-8-13(17)12-6-5-10-3-1-2-4-11(10)7-12/h1-7,13,16-17H,8-9H2,(H2,15,18)
InChIKeyIBHUWLYPHLOLHU-UHFFFAOYSA-N
MW244.29 g/mol
LogP0.95
Rot. Bonds5

About 2-[(2-hydroxy-2-naphthalen-2-ylethyl)amino]acetamide

2-[(2-hydroxy-2-naphthalen-2-ylethyl)amino]acetamide (PubChem CID 60899600) has the molecular formula C14H16N2O2 and a molecular weight of 244.29 g/mol. Its IUPAC name is 2-[(2-hydroxy-2-naphthalen-2-ylethyl)amino]acetamide.

Molecular Properties

Compound Name2-[(2-hydroxy-2-naphthalen-2-ylethyl)amino]acetamide
PubChem CID60899600
Molecular FormulaC14H16N2O2
Molecular Weight244.29 g/mol
Exact Mass244.12
IUPAC Name2-[(2-hydroxy-2-naphthalen-2-ylethyl)amino]acetamide
SMILESNC(=O)CNCC(O)c1ccc2ccccc2c1
InChIInChI=1S/C14H16N2O2/c15-14(18)9-16-8-13(17)12-6-5-10-3-1-2-4-11(10)7-12/h1-7,13,16-17H,8-9H2,(H2,15,18)
InChIKeyIBHUWLYPHLOLHU-UHFFFAOYSA-N
XLogP0.95
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 50.95
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(2-hydroxy-2-naphthalen-2-ylethyl)amino]acetamide?
The IUPAC name of 2-[(2-hydroxy-2-naphthalen-2-ylethyl)amino]acetamide (CID 60899600) is 2-[(2-hydroxy-2-naphthalen-2-ylethyl)amino]acetamide.
What is the SMILES notation for 2-[(2-hydroxy-2-naphthalen-2-ylethyl)amino]acetamide?
The canonical SMILES for 2-[(2-hydroxy-2-naphthalen-2-ylethyl)amino]acetamide is NC(=O)CNCC(O)c1ccc2ccccc2c1.
What is the InChIKey of 2-[(2-hydroxy-2-naphthalen-2-ylethyl)amino]acetamide?
The InChIKey is IBHUWLYPHLOLHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2/c15-14(18)9-16-8-13(17)12-6-5-10-3-1-2-4-11(10)7-12/h1-7,13,16-17H,8-9H2,(H2,15,18).
What are the key properties of 2-[(2-hydroxy-2-naphthalen-2-ylethyl)amino]acetamide?
2-[(2-hydroxy-2-naphthalen-2-ylethyl)amino]acetamide has a molecular weight of 244.29 g/mol, XLogP of 0.95, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-hydroxy-2-naphthalen-2-ylethyl)amino]acetamide is sourced from PubChem (CID 60899600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).