N-(2-methoxyphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)acetamide

C19H21NO3 — CID 100747328

IUPACN-(2-methoxyphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)acetamide
SMILESCOc1ccccc1NC(=O)COc1cccc2c1CCCC2
InChIInChI=1S/C19H21NO3/c1-22-18-11-5-4-10-16(18)20-19(21)13-23-17-12-6-8-14-7-2-3-9-15(14)17/h4-6,8,10-12H,2-3,7,9,13H2,1H3,(H,20,21)
InChIKeyRZJRNPRBNIPMKP-UHFFFAOYSA-N
MW311.38 g/mol
LogP3.59
Rot. Bonds5

About N-(2-methoxyphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)acetamide

N-(2-methoxyphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)acetamide (PubChem CID 100747328) has the molecular formula C19H21NO3 and a molecular weight of 311.38 g/mol. Its IUPAC name is N-(2-methoxyphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)acetamide.

Molecular Properties

Compound NameN-(2-methoxyphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)acetamide
PubChem CID100747328
Molecular FormulaC19H21NO3
Molecular Weight311.38 g/mol
Exact Mass311.15
IUPAC NameN-(2-methoxyphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)acetamide
SMILESCOc1ccccc1NC(=O)COc1cccc2c1CCCC2
InChIInChI=1S/C19H21NO3/c1-22-18-11-5-4-10-16(18)20-19(21)13-23-17-12-6-8-14-7-2-3-9-15(14)17/h4-6,8,10-12H,2-3,7,9,13H2,1H3,(H,20,21)
InChIKeyRZJRNPRBNIPMKP-UHFFFAOYSA-N
XLogP3.59
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.38
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)acetamide?
The IUPAC name of N-(2-methoxyphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)acetamide (CID 100747328) is N-(2-methoxyphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)acetamide.
What is the SMILES notation for N-(2-methoxyphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)acetamide?
The canonical SMILES for N-(2-methoxyphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)acetamide is COc1ccccc1NC(=O)COc1cccc2c1CCCC2.
What is the InChIKey of N-(2-methoxyphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)acetamide?
The InChIKey is RZJRNPRBNIPMKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21NO3/c1-22-18-11-5-4-10-16(18)20-19(21)13-23-17-12-6-8-14-7-2-3-9-15(14)17/h4-6,8,10-12H,2-3,7,9,13H2,1H3,(H,20,21).
What are the key properties of N-(2-methoxyphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)acetamide?
N-(2-methoxyphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)acetamide has a molecular weight of 311.38 g/mol, XLogP of 3.59, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)acetamide is sourced from PubChem (CID 100747328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).