2-phenoxy-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide

C18H19NO2 — CID 3891691

IUPAC2-phenoxy-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide
SMILESO=C(COc1ccccc1)NC1CCCc2ccccc21
InChIInChI=1S/C18H19NO2/c20-18(13-21-15-9-2-1-3-10-15)19-17-12-6-8-14-7-4-5-11-16(14)17/h1-5,7,9-11,17H,6,8,12-13H2,(H,19,20)
InChIKeyZQYPKHWWKLBAJV-UHFFFAOYSA-N
MW281.36 g/mol
LogP3.26
Rot. Bonds4

About 2-phenoxy-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide

2-phenoxy-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide (PubChem CID 3891691) has the molecular formula C18H19NO2 and a molecular weight of 281.36 g/mol. Its IUPAC name is 2-phenoxy-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide.

Molecular Properties

Compound Name2-phenoxy-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide
PubChem CID3891691
Molecular FormulaC18H19NO2
Molecular Weight281.36 g/mol
Exact Mass281.14
IUPAC Name2-phenoxy-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide
SMILESO=C(COc1ccccc1)NC1CCCc2ccccc21
InChIInChI=1S/C18H19NO2/c20-18(13-21-15-9-2-1-3-10-15)19-17-12-6-8-14-7-4-5-11-16(14)17/h1-5,7,9-11,17H,6,8,12-13H2,(H,19,20)
InChIKeyZQYPKHWWKLBAJV-UHFFFAOYSA-N
XLogP3.26
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-phenoxy-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide?
The IUPAC name of 2-phenoxy-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide (CID 3891691) is 2-phenoxy-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide.
What is the SMILES notation for 2-phenoxy-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide?
The canonical SMILES for 2-phenoxy-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide is O=C(COc1ccccc1)NC1CCCc2ccccc21.
What is the InChIKey of 2-phenoxy-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide?
The InChIKey is ZQYPKHWWKLBAJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19NO2/c20-18(13-21-15-9-2-1-3-10-15)19-17-12-6-8-14-7-4-5-11-16(14)17/h1-5,7,9-11,17H,6,8,12-13H2,(H,19,20).
What are the key properties of 2-phenoxy-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide?
2-phenoxy-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide has a molecular weight of 281.36 g/mol, XLogP of 3.26, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenoxy-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide is sourced from PubChem (CID 3891691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).