2-naphthalen-2-yloxy-N-(2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl)acetamide

C23H20N2O3 — CID 7384460

IUPAC2-naphthalen-2-yloxy-N-(2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl)acetamide
SMILESO=C(COc1ccc2ccccc2c1)Nc1cc2c3c(c1)CC(=O)N3CCC2
InChIInChI=1S/C23H20N2O3/c26-21(14-28-20-8-7-15-4-1-2-5-16(15)12-20)24-19-10-17-6-3-9-25-22(27)13-18(11-19)23(17)25/h1-2,4-5,7-8,10-12H,3,6,9,13-14H2,(H,24,26)
InChIKeyLVZOUCXNXGQYES-UHFFFAOYSA-N
MW372.42 g/mol
LogP3.69
Rot. Bonds4

About 2-naphthalen-2-yloxy-N-(2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl)acetamide

2-naphthalen-2-yloxy-N-(2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl)acetamide (PubChem CID 7384460) has the molecular formula C23H20N2O3 and a molecular weight of 372.42 g/mol. Its IUPAC name is 2-naphthalen-2-yloxy-N-(2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl)acetamide.

Molecular Properties

Compound Name2-naphthalen-2-yloxy-N-(2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl)acetamide
PubChem CID7384460
Molecular FormulaC23H20N2O3
Molecular Weight372.42 g/mol
Exact Mass372.15
IUPAC Name2-naphthalen-2-yloxy-N-(2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl)acetamide
SMILESO=C(COc1ccc2ccccc2c1)Nc1cc2c3c(c1)CC(=O)N3CCC2
InChIInChI=1S/C23H20N2O3/c26-21(14-28-20-8-7-15-4-1-2-5-16(15)12-20)24-19-10-17-6-3-9-25-22(27)13-18(11-19)23(17)25/h1-2,4-5,7-8,10-12H,3,6,9,13-14H2,(H,24,26)
InChIKeyLVZOUCXNXGQYES-UHFFFAOYSA-N
XLogP3.69
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.42
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-naphthalen-2-yloxy-N-(2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl)acetamide?
The IUPAC name of 2-naphthalen-2-yloxy-N-(2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl)acetamide (CID 7384460) is 2-naphthalen-2-yloxy-N-(2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl)acetamide.
What is the SMILES notation for 2-naphthalen-2-yloxy-N-(2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl)acetamide?
The canonical SMILES for 2-naphthalen-2-yloxy-N-(2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl)acetamide is O=C(COc1ccc2ccccc2c1)Nc1cc2c3c(c1)CC(=O)N3CCC2.
What is the InChIKey of 2-naphthalen-2-yloxy-N-(2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl)acetamide?
The InChIKey is LVZOUCXNXGQYES-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N2O3/c26-21(14-28-20-8-7-15-4-1-2-5-16(15)12-20)24-19-10-17-6-3-9-25-22(27)13-18(11-19)23(17)25/h1-2,4-5,7-8,10-12H,3,6,9,13-14H2,(H,24,26).
What are the key properties of 2-naphthalen-2-yloxy-N-(2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl)acetamide?
2-naphthalen-2-yloxy-N-(2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl)acetamide has a molecular weight of 372.42 g/mol, XLogP of 3.69, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-naphthalen-2-yloxy-N-(2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl)acetamide is sourced from PubChem (CID 7384460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).