2-[ethyl-(5-hydroxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]-N,N-dimethylacetamide

C16H24N2O2 — CID 82978326

IUPAC2-[ethyl-(5-hydroxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]-N,N-dimethylacetamide
SMILESCCN(CC(=O)N(C)C)C1CCCc2c(O)cccc21
InChIInChI=1S/C16H24N2O2/c1-4-18(11-16(20)17(2)3)14-9-5-8-13-12(14)7-6-10-15(13)19/h6-7,10,14,19H,4-5,8-9,11H2,1-3H3
InChIKeyLWTMJXIYNOBIRR-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.18
Rot. Bonds4

About 2-[ethyl-(5-hydroxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]-N,N-dimethylacetamide

2-[ethyl-(5-hydroxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]-N,N-dimethylacetamide (PubChem CID 82978326) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is 2-[ethyl-(5-hydroxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]-N,N-dimethylacetamide.

Molecular Properties

Compound Name2-[ethyl-(5-hydroxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]-N,N-dimethylacetamide
PubChem CID82978326
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC Name2-[ethyl-(5-hydroxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]-N,N-dimethylacetamide
SMILESCCN(CC(=O)N(C)C)C1CCCc2c(O)cccc21
InChIInChI=1S/C16H24N2O2/c1-4-18(11-16(20)17(2)3)14-9-5-8-13-12(14)7-6-10-15(13)19/h6-7,10,14,19H,4-5,8-9,11H2,1-3H3
InChIKeyLWTMJXIYNOBIRR-UHFFFAOYSA-N
XLogP2.18
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[ethyl-(5-hydroxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]-N,N-dimethylacetamide?
The IUPAC name of 2-[ethyl-(5-hydroxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]-N,N-dimethylacetamide (CID 82978326) is 2-[ethyl-(5-hydroxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]-N,N-dimethylacetamide.
What is the SMILES notation for 2-[ethyl-(5-hydroxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]-N,N-dimethylacetamide?
The canonical SMILES for 2-[ethyl-(5-hydroxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]-N,N-dimethylacetamide is CCN(CC(=O)N(C)C)C1CCCc2c(O)cccc21.
What is the InChIKey of 2-[ethyl-(5-hydroxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]-N,N-dimethylacetamide?
The InChIKey is LWTMJXIYNOBIRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-4-18(11-16(20)17(2)3)14-9-5-8-13-12(14)7-6-10-15(13)19/h6-7,10,14,19H,4-5,8-9,11H2,1-3H3.
What are the key properties of 2-[ethyl-(5-hydroxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]-N,N-dimethylacetamide?
2-[ethyl-(5-hydroxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]-N,N-dimethylacetamide has a molecular weight of 276.38 g/mol, XLogP of 2.18, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl-(5-hydroxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]-N,N-dimethylacetamide is sourced from PubChem (CID 82978326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).