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

C18H17Cl2NO2 — CID 100534852

IUPACN-(2,5-dichlorophenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)acetamide
SMILESO=C(COc1cccc2c1CCCC2)Nc1cc(Cl)ccc1Cl
InChIInChI=1S/C18H17Cl2NO2/c19-13-8-9-15(20)16(10-13)21-18(22)11-23-17-7-3-5-12-4-1-2-6-14(12)17/h3,5,7-10H,1-2,4,6,11H2,(H,21,22)
InChIKeyPLTFOJRFUJWLMG-UHFFFAOYSA-N
MW350.25 g/mol
LogP4.89
Rot. Bonds4

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

N-(2,5-dichlorophenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)acetamide (PubChem CID 100534852) has the molecular formula C18H17Cl2NO2 and a molecular weight of 350.25 g/mol. Its IUPAC name is N-(2,5-dichlorophenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)acetamide.

Molecular Properties

Compound NameN-(2,5-dichlorophenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)acetamide
PubChem CID100534852
Molecular FormulaC18H17Cl2NO2
Molecular Weight350.25 g/mol
Exact Mass349.06
IUPAC NameN-(2,5-dichlorophenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)acetamide
SMILESO=C(COc1cccc2c1CCCC2)Nc1cc(Cl)ccc1Cl
InChIInChI=1S/C18H17Cl2NO2/c19-13-8-9-15(20)16(10-13)21-18(22)11-23-17-7-3-5-12-4-1-2-6-14(12)17/h3,5,7-10H,1-2,4,6,11H2,(H,21,22)
InChIKeyPLTFOJRFUJWLMG-UHFFFAOYSA-N
XLogP4.89
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.25
LogP ≤ 54.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-chloro-4-fluorophenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)acetamide
CID 100719602
N-(2-methoxyphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)acetamide
CID 100747328
N-(2-methoxy-5-methylphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)acetamide
CID 100765455
2-(2-acetamidophenoxy)-N-(2,5-dichlorophenyl)acetamide
CID 7867306
N-[2-(2-chlorophenoxy)ethyl]-2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)acetamide
CID 100663620
2-(2-bromo-4-fluorophenoxy)-N-(2,5-dichlorophenyl)acetamide
CID 7899911
methyl 3-chloro-4-[2-(2,5-dichloroanilino)-2-oxoethoxy]benzoate
CID 55321046
2-(2,4-dichlorophenoxy)-N-(1,2-dihydroacenaphthylen-5-yl)acetamide
CID 3974459
2-[2-(2-fluoroanilino)-2-oxoethoxy]-N-(5,6,7,8-tetrahydronaphthalen-1-yl)benzamide
CID 26516196
N-(5-chloro-2-fluorophenyl)-2-(2,3-dimethylphenoxy)acetamide
CID 8759085
2-[[2-(4-chloro-2-methylphenoxy)acetyl]amino]-N-(2,5-dichlorophenyl)acetamide
CID 7936907
[2-(2,5-dichloroanilino)-2-oxoethyl] 2-(2-methoxyphenoxy)acetate
CID 7854137

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dichlorophenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)acetamide?
The IUPAC name of N-(2,5-dichlorophenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)acetamide (CID 100534852) is N-(2,5-dichlorophenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)acetamide.
What is the SMILES notation for N-(2,5-dichlorophenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)acetamide?
The canonical SMILES for N-(2,5-dichlorophenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)acetamide is O=C(COc1cccc2c1CCCC2)Nc1cc(Cl)ccc1Cl.
What is the InChIKey of N-(2,5-dichlorophenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)acetamide?
The InChIKey is PLTFOJRFUJWLMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17Cl2NO2/c19-13-8-9-15(20)16(10-13)21-18(22)11-23-17-7-3-5-12-4-1-2-6-14(12)17/h3,5,7-10H,1-2,4,6,11H2,(H,21,22).
What are the key properties of N-(2,5-dichlorophenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)acetamide?
N-(2,5-dichlorophenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)acetamide has a molecular weight of 350.25 g/mol, XLogP of 4.89, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dichlorophenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)acetamide is sourced from PubChem (CID 100534852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).