2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)-N-[1-(2,4,5-trimethylphenyl)ethyl]acetamide

C23H29NO2 — CID 133220383

IUPAC2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)-N-[1-(2,4,5-trimethylphenyl)ethyl]acetamide
SMILESCc1cc(C)c(C(C)NC(=O)COc2cccc3c2CCCC3)cc1C
InChIInChI=1S/C23H29NO2/c1-15-12-17(3)21(13-16(15)2)18(4)24-23(25)14-26-22-11-7-9-19-8-5-6-10-20(19)22/h7,9,11-13,18H,5-6,8,10,14H2,1-4H3,(H,24,25)
InChIKeyNIIUHZRKRJJIBF-UHFFFAOYSA-N
MW351.49 g/mol
LogP4.75
Rot. Bonds5

About 2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)-N-[1-(2,4,5-trimethylphenyl)ethyl]acetamide

2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)-N-[1-(2,4,5-trimethylphenyl)ethyl]acetamide (PubChem CID 133220383) has the molecular formula C23H29NO2 and a molecular weight of 351.49 g/mol. Its IUPAC name is 2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)-N-[1-(2,4,5-trimethylphenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)-N-[1-(2,4,5-trimethylphenyl)ethyl]acetamide
PubChem CID133220383
Molecular FormulaC23H29NO2
Molecular Weight351.49 g/mol
Exact Mass351.22
IUPAC Name2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)-N-[1-(2,4,5-trimethylphenyl)ethyl]acetamide
SMILESCc1cc(C)c(C(C)NC(=O)COc2cccc3c2CCCC3)cc1C
InChIInChI=1S/C23H29NO2/c1-15-12-17(3)21(13-16(15)2)18(4)24-23(25)14-26-22-11-7-9-19-8-5-6-10-20(19)22/h7,9,11-13,18H,5-6,8,10,14H2,1-4H3,(H,24,25)
InChIKeyNIIUHZRKRJJIBF-UHFFFAOYSA-N
XLogP4.75
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.49
LogP ≤ 54.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(1R)-1-(4-methylphenyl)propyl]-2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)acetamide
CID 100681308
2-phenoxy-N-[(1R)-1-(2,4,5-trimethylphenyl)ethyl]acetamide
CID 30402629
N-[1-(3,4-dimethoxyphenyl)propyl]-2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)acetamide
CID 133199402
N-propan-2-yl-2-[[2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)acetyl]amino]benzamide
CID 100502815
N-(2-methoxy-5-methylphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)acetamide
CID 100765455
N-(2-methoxyphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)acetamide
CID 100747328
4-methyl-1-(5,6,7,8-tetrahydronaphthalen-1-yloxy)pentan-3-one
CID 39349304
2-[4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenoxy]-N-[(1S)-1-(2,4,5-trimethylphenyl)ethyl]acetamide
CID 30401935
2-(4-chlorophenoxy)-N-[1-(2,4,5-trimethylphenyl)ethyl]acetamide
CID 133217637
N-[(2-ethoxyphenyl)methyl]-2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)acetamide
CID 100721805
N-[1-(4-methoxy-2-methyl-5-propan-2-ylphenyl)ethyl]-2-naphthalen-1-yloxyacetamide
CID 133186578
N-[2-(4-methylphenoxy)ethyl]-2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)acetamide
CID 100723383

Frequently Asked Questions

What is the IUPAC name of 2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)-N-[1-(2,4,5-trimethylphenyl)ethyl]acetamide?
The IUPAC name of 2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)-N-[1-(2,4,5-trimethylphenyl)ethyl]acetamide (CID 133220383) is 2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)-N-[1-(2,4,5-trimethylphenyl)ethyl]acetamide.
What is the SMILES notation for 2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)-N-[1-(2,4,5-trimethylphenyl)ethyl]acetamide?
The canonical SMILES for 2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)-N-[1-(2,4,5-trimethylphenyl)ethyl]acetamide is Cc1cc(C)c(C(C)NC(=O)COc2cccc3c2CCCC3)cc1C.
What is the InChIKey of 2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)-N-[1-(2,4,5-trimethylphenyl)ethyl]acetamide?
The InChIKey is NIIUHZRKRJJIBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H29NO2/c1-15-12-17(3)21(13-16(15)2)18(4)24-23(25)14-26-22-11-7-9-19-8-5-6-10-20(19)22/h7,9,11-13,18H,5-6,8,10,14H2,1-4H3,(H,24,25).
What are the key properties of 2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)-N-[1-(2,4,5-trimethylphenyl)ethyl]acetamide?
2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)-N-[1-(2,4,5-trimethylphenyl)ethyl]acetamide has a molecular weight of 351.49 g/mol, XLogP of 4.75, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)-N-[1-(2,4,5-trimethylphenyl)ethyl]acetamide is sourced from PubChem (CID 133220383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).