N-[3-chloro-4-(4-chloronaphthalen-1-yl)oxyphenyl]-2-(2-methoxyphenyl)acetamide

C25H19Cl2NO3 — CID 23792360

IUPACN-[3-chloro-4-(4-chloronaphthalen-1-yl)oxyphenyl]-2-(2-methoxyphenyl)acetamide
SMILESCOc1ccccc1CC(=O)Nc1ccc(Oc2ccc(Cl)c3ccccc23)c(Cl)c1
InChIInChI=1S/C25H19Cl2NO3/c1-30-22-9-5-2-6-16(22)14-25(29)28-17-10-12-24(21(27)15-17)31-23-13-11-20(26)18-7-3-4-8-19(18)23/h2-13,15H,14H2,1H3,(H,28,29)
InChIKeyWILIKHANTXRGET-UHFFFAOYSA-N
MW452.34 g/mol
LogP7.13
Rot. Bonds6

About N-[3-chloro-4-(4-chloronaphthalen-1-yl)oxyphenyl]-2-(2-methoxyphenyl)acetamide

N-[3-chloro-4-(4-chloronaphthalen-1-yl)oxyphenyl]-2-(2-methoxyphenyl)acetamide (PubChem CID 23792360) has the molecular formula C25H19Cl2NO3 and a molecular weight of 452.34 g/mol. Its IUPAC name is N-[3-chloro-4-(4-chloronaphthalen-1-yl)oxyphenyl]-2-(2-methoxyphenyl)acetamide.

Molecular Properties

Compound NameN-[3-chloro-4-(4-chloronaphthalen-1-yl)oxyphenyl]-2-(2-methoxyphenyl)acetamide
PubChem CID23792360
Molecular FormulaC25H19Cl2NO3
Molecular Weight452.34 g/mol
Exact Mass451.07
IUPAC NameN-[3-chloro-4-(4-chloronaphthalen-1-yl)oxyphenyl]-2-(2-methoxyphenyl)acetamide
SMILESCOc1ccccc1CC(=O)Nc1ccc(Oc2ccc(Cl)c3ccccc23)c(Cl)c1
InChIInChI=1S/C25H19Cl2NO3/c1-30-22-9-5-2-6-16(22)14-25(29)28-17-10-12-24(21(27)15-17)31-23-13-11-20(26)18-7-3-4-8-19(18)23/h2-13,15H,14H2,1H3,(H,28,29)
InChIKeyWILIKHANTXRGET-UHFFFAOYSA-N
XLogP7.13
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500452.34
LogP ≤ 57.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-methoxy-3-methylphenyl)-2-(2-methoxyphenyl)acetamide
CID 110776428
1-(3-chloro-4-methoxyphenyl)-3-[(2-methoxyphenyl)methyl]urea
CID 38158814
N-(3-chloro-4-methoxyphenyl)-2-(2-ethylphenoxy)acetamide
CID 2709417
N-[2-(3-chloro-4-methoxyanilino)-2-oxoethyl]-2-(2-methylphenyl)acetamide
CID 112998357
N-(1,4-dioxo-2,3-dihydrophthalazin-6-yl)-2-(2-methoxyphenyl)acetamide
CID 110734555
2-(2-methoxyphenyl)-N-(2,4,5-trichlorophenyl)acetamide
CID 3375078
N-(3-hydroxyphenyl)-2-(2-methoxyphenyl)acetamide
CID 43082666
[(2S)-1-(3-chloro-4-methoxyanilino)-1-oxopropan-2-yl] 2-(2-methoxyphenyl)acetate
CID 8886294
N-[4-(4-bromonaphthalen-1-yl)oxy-3-chlorophenyl]acetamide
CID 539400
N-(4-bromophenyl)-2-(2-methoxyphenyl)acetamide
CID 2263112
N-(3-chloro-4-methoxyphenyl)butanamide
CID 875969
N-[(5-acetamido-2-methoxyphenyl)methyl]-2-(2-chlorophenyl)acetamide
CID 110784166

Frequently Asked Questions

What is the IUPAC name of N-[3-chloro-4-(4-chloronaphthalen-1-yl)oxyphenyl]-2-(2-methoxyphenyl)acetamide?
The IUPAC name of N-[3-chloro-4-(4-chloronaphthalen-1-yl)oxyphenyl]-2-(2-methoxyphenyl)acetamide (CID 23792360) is N-[3-chloro-4-(4-chloronaphthalen-1-yl)oxyphenyl]-2-(2-methoxyphenyl)acetamide.
What is the SMILES notation for N-[3-chloro-4-(4-chloronaphthalen-1-yl)oxyphenyl]-2-(2-methoxyphenyl)acetamide?
The canonical SMILES for N-[3-chloro-4-(4-chloronaphthalen-1-yl)oxyphenyl]-2-(2-methoxyphenyl)acetamide is COc1ccccc1CC(=O)Nc1ccc(Oc2ccc(Cl)c3ccccc23)c(Cl)c1.
What is the InChIKey of N-[3-chloro-4-(4-chloronaphthalen-1-yl)oxyphenyl]-2-(2-methoxyphenyl)acetamide?
The InChIKey is WILIKHANTXRGET-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H19Cl2NO3/c1-30-22-9-5-2-6-16(22)14-25(29)28-17-10-12-24(21(27)15-17)31-23-13-11-20(26)18-7-3-4-8-19(18)23/h2-13,15H,14H2,1H3,(H,28,29).
What are the key properties of N-[3-chloro-4-(4-chloronaphthalen-1-yl)oxyphenyl]-2-(2-methoxyphenyl)acetamide?
N-[3-chloro-4-(4-chloronaphthalen-1-yl)oxyphenyl]-2-(2-methoxyphenyl)acetamide has a molecular weight of 452.34 g/mol, XLogP of 7.13, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-chloro-4-(4-chloronaphthalen-1-yl)oxyphenyl]-2-(2-methoxyphenyl)acetamide is sourced from PubChem (CID 23792360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).