3-methoxy-2-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)benzamide

C20H23NO2 — CID 166351622

IUPAC3-methoxy-2-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)benzamide
SMILESCOc1cccc(C(=O)NCC2CCCc3ccccc32)c1C
InChIInChI=1S/C20H23NO2/c1-14-17(11-6-12-19(14)23-2)20(22)21-13-16-9-5-8-15-7-3-4-10-18(15)16/h3-4,6-7,10-12,16H,5,8-9,13H2,1-2H3,(H,21,22)
InChIKeyKYPJEPPWTKVZQG-UHFFFAOYSA-N
MW309.41 g/mol
LogP3.85
Rot. Bonds4

About 3-methoxy-2-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)benzamide

3-methoxy-2-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)benzamide (PubChem CID 166351622) has the molecular formula C20H23NO2 and a molecular weight of 309.41 g/mol. Its IUPAC name is 3-methoxy-2-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)benzamide.

Molecular Properties

Compound Name3-methoxy-2-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)benzamide
PubChem CID166351622
Molecular FormulaC20H23NO2
Molecular Weight309.41 g/mol
Exact Mass309.17
IUPAC Name3-methoxy-2-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)benzamide
SMILESCOc1cccc(C(=O)NCC2CCCc3ccccc32)c1C
InChIInChI=1S/C20H23NO2/c1-14-17(11-6-12-19(14)23-2)20(22)21-13-16-9-5-8-15-7-3-4-10-18(15)16/h3-4,6-7,10-12,16H,5,8-9,13H2,1-2H3,(H,21,22)
InChIKeyKYPJEPPWTKVZQG-UHFFFAOYSA-N
XLogP3.85
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.41
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(3-methoxy-2-methylphenyl)methyl]-2-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide
CID 167812395
5-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)-1H-pyrazole-4-carboxamide
CID 126767967
1,5-dimethyl-N-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)pyrazole-4-carboxamide
CID 126768716
3-(3,4-dimethoxyphenyl)-N-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)propanamide
CID 46568284
6-(1,2,3,4-tetrahydronaphthalen-1-ylmethylcarbamoyl)pyridine-2-carboxylic acid
CID 119181193
4-ethoxy-N-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)benzamide
CID 46578689
6-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)pyridine-3-carboxamide
CID 42888995
N-[(2-methoxyphenyl)methyl]-1-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine
CID 60733536
N-[[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]methyl]pyridine-2-carboxamide
CID 39991451
4-methoxy-N-methyl-3-(1,2,3,4-tetrahydronaphthalen-1-ylmethylcarbamoylamino)benzamide
CID 86994987
methyl 2-(1,2,3,4-tetrahydronaphthalen-1-ylmethylamino)acetate
CID 63771406
2-methoxy-N-[3-oxo-3-[[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]amino]propyl]benzamide
CID 41135260

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-2-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)benzamide?
The IUPAC name of 3-methoxy-2-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)benzamide (CID 166351622) is 3-methoxy-2-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)benzamide.
What is the SMILES notation for 3-methoxy-2-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)benzamide?
The canonical SMILES for 3-methoxy-2-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)benzamide is COc1cccc(C(=O)NCC2CCCc3ccccc32)c1C.
What is the InChIKey of 3-methoxy-2-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)benzamide?
The InChIKey is KYPJEPPWTKVZQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23NO2/c1-14-17(11-6-12-19(14)23-2)20(22)21-13-16-9-5-8-15-7-3-4-10-18(15)16/h3-4,6-7,10-12,16H,5,8-9,13H2,1-2H3,(H,21,22).
What are the key properties of 3-methoxy-2-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)benzamide?
3-methoxy-2-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)benzamide has a molecular weight of 309.41 g/mol, XLogP of 3.85, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-2-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)benzamide is sourced from PubChem (CID 166351622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).