2-(2,4-dichlorophenoxy)-N-(1,2-dihydroacenaphthylen-5-yl)acetamide

C20H15Cl2NO2 — CID 3974459

IUPAC2-(2,4-dichlorophenoxy)-N-(1,2-dihydroacenaphthylen-5-yl)acetamide
SMILESO=C(COc1ccc(Cl)cc1Cl)Nc1ccc2c3c(cccc13)CC2
InChIInChI=1S/C20H15Cl2NO2/c21-14-7-9-18(16(22)10-14)25-11-19(24)23-17-8-6-13-5-4-12-2-1-3-15(17)20(12)13/h1-3,6-10H,4-5,11H2,(H,23,24)
InChIKeyXKQVPHFAIJAYEU-UHFFFAOYSA-N
MW372.25 g/mol
LogP5.26
Rot. Bonds4

About 2-(2,4-dichlorophenoxy)-N-(1,2-dihydroacenaphthylen-5-yl)acetamide

2-(2,4-dichlorophenoxy)-N-(1,2-dihydroacenaphthylen-5-yl)acetamide (PubChem CID 3974459) has the molecular formula C20H15Cl2NO2 and a molecular weight of 372.25 g/mol. Its IUPAC name is 2-(2,4-dichlorophenoxy)-N-(1,2-dihydroacenaphthylen-5-yl)acetamide.

Molecular Properties

Compound Name2-(2,4-dichlorophenoxy)-N-(1,2-dihydroacenaphthylen-5-yl)acetamide
PubChem CID3974459
Molecular FormulaC20H15Cl2NO2
Molecular Weight372.25 g/mol
Exact Mass371.05
IUPAC Name2-(2,4-dichlorophenoxy)-N-(1,2-dihydroacenaphthylen-5-yl)acetamide
SMILESO=C(COc1ccc(Cl)cc1Cl)Nc1ccc2c3c(cccc13)CC2
InChIInChI=1S/C20H15Cl2NO2/c21-14-7-9-18(16(22)10-14)25-11-19(24)23-17-8-6-13-5-4-12-2-1-3-15(17)20(12)13/h1-3,6-10H,4-5,11H2,(H,23,24)
InChIKeyXKQVPHFAIJAYEU-UHFFFAOYSA-N
XLogP5.26
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500372.25
LogP ≤ 55.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1,2-dihydroacenaphthylen-5-yl)-2-(2,3-dimethylphenoxy)acetamide
CID 806562
N-(2-chlorophenyl)-2-(2,4-dichlorophenoxy)acetamide
CID 744320
2-(2,4-dichlorophenoxy)-N-[4-(dimethylamino)naphthalen-1-yl]acetamide
CID 1343301
2-(2,4-dichlorophenoxy)-N-[2-[2-[[2-(2,4-dichlorophenoxy)acetyl]amino]phenyl]phenyl]acetamide
CID 2198238
5-chloro-2-[[2-(2,4-dichlorophenoxy)acetyl]amino]benzamide
CID 122187999
N-(1-butyl-2-oxobenzo[cd]indol-6-yl)-2-(2,4-dichlorophenoxy)acetamide
CID 23911990
4-(2,4-dichlorophenoxy)-N-naphthalen-1-ylbutanamide
CID 2177409
2-[2-[[2-(2,4-dichlorophenoxy)acetyl]amino]phenyl]acetic acid
CID 166178801
2-(2,4-dichlorophenoxy)-N-[4-[4-[[2-(2,4-dichlorophenoxy)acetyl]amino]-3-methylphenyl]-2-methylphenyl]acetamide
CID 2827268
2-(2,5-dichlorophenoxy)-N-naphthalen-1-ylacetamide
CID 19167989
N-(2-benzoyl-4-chlorophenyl)-2-(2,4-dichlorophenoxy)acetamide
CID 3544695
2-(2,4-dichlorophenoxy)-N-quinolin-8-ylacetamide
CID 2180532

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichlorophenoxy)-N-(1,2-dihydroacenaphthylen-5-yl)acetamide?
The IUPAC name of 2-(2,4-dichlorophenoxy)-N-(1,2-dihydroacenaphthylen-5-yl)acetamide (CID 3974459) is 2-(2,4-dichlorophenoxy)-N-(1,2-dihydroacenaphthylen-5-yl)acetamide.
What is the SMILES notation for 2-(2,4-dichlorophenoxy)-N-(1,2-dihydroacenaphthylen-5-yl)acetamide?
The canonical SMILES for 2-(2,4-dichlorophenoxy)-N-(1,2-dihydroacenaphthylen-5-yl)acetamide is O=C(COc1ccc(Cl)cc1Cl)Nc1ccc2c3c(cccc13)CC2.
What is the InChIKey of 2-(2,4-dichlorophenoxy)-N-(1,2-dihydroacenaphthylen-5-yl)acetamide?
The InChIKey is XKQVPHFAIJAYEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15Cl2NO2/c21-14-7-9-18(16(22)10-14)25-11-19(24)23-17-8-6-13-5-4-12-2-1-3-15(17)20(12)13/h1-3,6-10H,4-5,11H2,(H,23,24).
What are the key properties of 2-(2,4-dichlorophenoxy)-N-(1,2-dihydroacenaphthylen-5-yl)acetamide?
2-(2,4-dichlorophenoxy)-N-(1,2-dihydroacenaphthylen-5-yl)acetamide has a molecular weight of 372.25 g/mol, XLogP of 5.26, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dichlorophenoxy)-N-(1,2-dihydroacenaphthylen-5-yl)acetamide is sourced from PubChem (CID 3974459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).