2-[ethyl(2-hydroxyethyl)amino]-N-naphthalen-1-ylacetamide

C16H20N2O2 — CID 31993077

IUPAC2-[ethyl(2-hydroxyethyl)amino]-N-naphthalen-1-ylacetamide
SMILESCCN(CCO)CC(=O)Nc1cccc2ccccc12
InChIInChI=1S/C16H20N2O2/c1-2-18(10-11-19)12-16(20)17-15-9-5-7-13-6-3-4-8-14(13)15/h3-9,19H,2,10-12H2,1H3,(H,17,20)
InChIKeyUDXPIJNWURXSTE-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.09
Rot. Bonds6

About 2-[ethyl(2-hydroxyethyl)amino]-N-naphthalen-1-ylacetamide

2-[ethyl(2-hydroxyethyl)amino]-N-naphthalen-1-ylacetamide (PubChem CID 31993077) has the molecular formula C16H20N2O2 and a molecular weight of 272.35 g/mol. Its IUPAC name is 2-[ethyl(2-hydroxyethyl)amino]-N-naphthalen-1-ylacetamide.

Molecular Properties

Compound Name2-[ethyl(2-hydroxyethyl)amino]-N-naphthalen-1-ylacetamide
PubChem CID31993077
Molecular FormulaC16H20N2O2
Molecular Weight272.35 g/mol
Exact Mass272.15
IUPAC Name2-[ethyl(2-hydroxyethyl)amino]-N-naphthalen-1-ylacetamide
SMILESCCN(CCO)CC(=O)Nc1cccc2ccccc12
InChIInChI=1S/C16H20N2O2/c1-2-18(10-11-19)12-16(20)17-15-9-5-7-13-6-3-4-8-14(13)15/h3-9,19H,2,10-12H2,1H3,(H,17,20)
InChIKeyUDXPIJNWURXSTE-UHFFFAOYSA-N
XLogP2.09
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[ethyl(2-hydroxyethyl)amino]-N-naphthalen-1-ylacetamide?
The IUPAC name of 2-[ethyl(2-hydroxyethyl)amino]-N-naphthalen-1-ylacetamide (CID 31993077) is 2-[ethyl(2-hydroxyethyl)amino]-N-naphthalen-1-ylacetamide.
What is the SMILES notation for 2-[ethyl(2-hydroxyethyl)amino]-N-naphthalen-1-ylacetamide?
The canonical SMILES for 2-[ethyl(2-hydroxyethyl)amino]-N-naphthalen-1-ylacetamide is CCN(CCO)CC(=O)Nc1cccc2ccccc12.
What is the InChIKey of 2-[ethyl(2-hydroxyethyl)amino]-N-naphthalen-1-ylacetamide?
The InChIKey is UDXPIJNWURXSTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O2/c1-2-18(10-11-19)12-16(20)17-15-9-5-7-13-6-3-4-8-14(13)15/h3-9,19H,2,10-12H2,1H3,(H,17,20).
What are the key properties of 2-[ethyl(2-hydroxyethyl)amino]-N-naphthalen-1-ylacetamide?
2-[ethyl(2-hydroxyethyl)amino]-N-naphthalen-1-ylacetamide has a molecular weight of 272.35 g/mol, XLogP of 2.09, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl(2-hydroxyethyl)amino]-N-naphthalen-1-ylacetamide is sourced from PubChem (CID 31993077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).