N-(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)benzamide

C18H19NO2 — CID 11778472

IUPACN-(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)benzamide
SMILESCOc1cccc2c1CC(NC(=O)c1ccccc1)CC2
InChIInChI=1S/C18H19NO2/c1-21-17-9-5-8-13-10-11-15(12-16(13)17)19-18(20)14-6-3-2-4-7-14/h2-9,15H,10-12H2,1H3,(H,19,20)
InChIKeyKLJIYXYXXSWFOJ-UHFFFAOYSA-N
MW281.36 g/mol
LogP2.98
Rot. Bonds3

About N-(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)benzamide

N-(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)benzamide (PubChem CID 11778472) has the molecular formula C18H19NO2 and a molecular weight of 281.36 g/mol. Its IUPAC name is N-(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)benzamide.

Molecular Properties

Compound NameN-(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)benzamide
PubChem CID11778472
Molecular FormulaC18H19NO2
Molecular Weight281.36 g/mol
Exact Mass281.14
IUPAC NameN-(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)benzamide
SMILESCOc1cccc2c1CC(NC(=O)c1ccccc1)CC2
InChIInChI=1S/C18H19NO2/c1-21-17-9-5-8-13-10-11-15(12-16(13)17)19-18(20)14-6-3-2-4-7-14/h2-9,15H,10-12H2,1H3,(H,19,20)
InChIKeyKLJIYXYXXSWFOJ-UHFFFAOYSA-N
XLogP2.98
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)benzamide?
The IUPAC name of N-(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)benzamide (CID 11778472) is N-(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)benzamide.
What is the SMILES notation for N-(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)benzamide?
The canonical SMILES for N-(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)benzamide is COc1cccc2c1CC(NC(=O)c1ccccc1)CC2.
What is the InChIKey of N-(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)benzamide?
The InChIKey is KLJIYXYXXSWFOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19NO2/c1-21-17-9-5-8-13-10-11-15(12-16(13)17)19-18(20)14-6-3-2-4-7-14/h2-9,15H,10-12H2,1H3,(H,19,20).
What are the key properties of N-(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)benzamide?
N-(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)benzamide has a molecular weight of 281.36 g/mol, XLogP of 2.98, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)benzamide is sourced from PubChem (CID 11778472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).