N-(4-chlorophenyl)-2-(2,4-dichlorophenoxy)-N-(furan-2-ylmethyl)acetamide

C19H14Cl3NO3 — CID 35182106

IUPACN-(4-chlorophenyl)-2-(2,4-dichlorophenoxy)-N-(furan-2-ylmethyl)acetamide
SMILESO=C(COc1ccc(Cl)cc1Cl)N(Cc1ccco1)c1ccc(Cl)cc1
InChIInChI=1S/C19H14Cl3NO3/c20-13-3-6-15(7-4-13)23(11-16-2-1-9-25-16)19(24)12-26-18-8-5-14(21)10-17(18)22/h1-10H,11-12H2
InChIKeyNVMSCHCUFADRNS-UHFFFAOYSA-N
MW410.68 g/mol
LogP5.85
Rot. Bonds6

About N-(4-chlorophenyl)-2-(2,4-dichlorophenoxy)-N-(furan-2-ylmethyl)acetamide

N-(4-chlorophenyl)-2-(2,4-dichlorophenoxy)-N-(furan-2-ylmethyl)acetamide (PubChem CID 35182106) has the molecular formula C19H14Cl3NO3 and a molecular weight of 410.68 g/mol. Its IUPAC name is N-(4-chlorophenyl)-2-(2,4-dichlorophenoxy)-N-(furan-2-ylmethyl)acetamide.

Molecular Properties

Compound NameN-(4-chlorophenyl)-2-(2,4-dichlorophenoxy)-N-(furan-2-ylmethyl)acetamide
PubChem CID35182106
Molecular FormulaC19H14Cl3NO3
Molecular Weight410.68 g/mol
Exact Mass409.00
IUPAC NameN-(4-chlorophenyl)-2-(2,4-dichlorophenoxy)-N-(furan-2-ylmethyl)acetamide
SMILESO=C(COc1ccc(Cl)cc1Cl)N(Cc1ccco1)c1ccc(Cl)cc1
InChIInChI=1S/C19H14Cl3NO3/c20-13-3-6-15(7-4-13)23(11-16-2-1-9-25-16)19(24)12-26-18-8-5-14(21)10-17(18)22/h1-10H,11-12H2
InChIKeyNVMSCHCUFADRNS-UHFFFAOYSA-N
XLogP5.85
TPSA42.68 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500410.68
LogP ≤ 55.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-chlorophenoxy)-N-(4-chlorophenyl)-N-(furan-2-ylmethyl)acetamide
CID 35181974
N-(furan-2-ylmethyl)-2-(2-methoxy-4-methylphenoxy)-N-(4-methylphenyl)acetamide
CID 31964022
2-amino-N-(4-chlorophenyl)-N-(furan-2-ylmethyl)acetamide
CID 39364356
2-(2,5-dichlorophenoxy)-N-(furan-2-ylmethyl)-N-methylacetamide
CID 84601511
N-(furan-2-ylmethyl)-2-(2-methoxyphenoxy)-N-phenylacetamide
CID 18100575
N-[2-(2,4-dichlorophenoxy)ethyl]-2-phenoxy-N-phenylacetamide
CID 3374858
3-(3-chlorophenyl)-1-(4-chlorophenyl)-1-(furan-2-ylmethyl)urea
CID 3721578
2-(2-chloro-4-cyanophenoxy)-N-(2-cyanoethyl)-N-(furan-2-ylmethyl)acetamide
CID 8977371
2-chloro-N-(3-chlorophenyl)-N-(furan-2-ylmethyl)acetamide
CID 39384213
N-[2-(2,4-dichlorophenyl)ethyl]-N-(furan-2-ylmethyl)-2-phenoxyacetamide
CID 42709076
1-[[2-(2,4-dichlorophenoxy)acetyl]-(furan-2-ylmethyl)amino]-N-(3-methylphenyl)cyclopentane-1-carboxamide
CID 1047305
2-(3-chlorophenoxy)-N-(furan-2-ylmethyl)-N-pyridin-2-ylacetamide
CID 23613582

Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)-2-(2,4-dichlorophenoxy)-N-(furan-2-ylmethyl)acetamide?
The IUPAC name of N-(4-chlorophenyl)-2-(2,4-dichlorophenoxy)-N-(furan-2-ylmethyl)acetamide (CID 35182106) is N-(4-chlorophenyl)-2-(2,4-dichlorophenoxy)-N-(furan-2-ylmethyl)acetamide.
What is the SMILES notation for N-(4-chlorophenyl)-2-(2,4-dichlorophenoxy)-N-(furan-2-ylmethyl)acetamide?
The canonical SMILES for N-(4-chlorophenyl)-2-(2,4-dichlorophenoxy)-N-(furan-2-ylmethyl)acetamide is O=C(COc1ccc(Cl)cc1Cl)N(Cc1ccco1)c1ccc(Cl)cc1.
What is the InChIKey of N-(4-chlorophenyl)-2-(2,4-dichlorophenoxy)-N-(furan-2-ylmethyl)acetamide?
The InChIKey is NVMSCHCUFADRNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14Cl3NO3/c20-13-3-6-15(7-4-13)23(11-16-2-1-9-25-16)19(24)12-26-18-8-5-14(21)10-17(18)22/h1-10H,11-12H2.
What are the key properties of N-(4-chlorophenyl)-2-(2,4-dichlorophenoxy)-N-(furan-2-ylmethyl)acetamide?
N-(4-chlorophenyl)-2-(2,4-dichlorophenoxy)-N-(furan-2-ylmethyl)acetamide has a molecular weight of 410.68 g/mol, XLogP of 5.85, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)-2-(2,4-dichlorophenoxy)-N-(furan-2-ylmethyl)acetamide is sourced from PubChem (CID 35182106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).