2-(4-methoxyanilino)-N-[2-(4-methoxyphenoxy)ethyl]-N-methylbenzamide

C24H26N2O4 — CID 55720016

IUPAC2-(4-methoxyanilino)-N-[2-(4-methoxyphenoxy)ethyl]-N-methylbenzamide
SMILESCOc1ccc(Nc2ccccc2C(=O)N(C)CCOc2ccc(OC)cc2)cc1
InChIInChI=1S/C24H26N2O4/c1-26(16-17-30-21-14-12-20(29-3)13-15-21)24(27)22-6-4-5-7-23(22)25-18-8-10-19(28-2)11-9-18/h4-15,25H,16-17H2,1-3H3
InChIKeyKFCWPUQKYDNBTQ-UHFFFAOYSA-N
MW406.48 g/mol
LogP4.60
Rot. Bonds9

About 2-(4-methoxyanilino)-N-[2-(4-methoxyphenoxy)ethyl]-N-methylbenzamide

2-(4-methoxyanilino)-N-[2-(4-methoxyphenoxy)ethyl]-N-methylbenzamide (PubChem CID 55720016) has the molecular formula C24H26N2O4 and a molecular weight of 406.48 g/mol. Its IUPAC name is 2-(4-methoxyanilino)-N-[2-(4-methoxyphenoxy)ethyl]-N-methylbenzamide.

Molecular Properties

Compound Name2-(4-methoxyanilino)-N-[2-(4-methoxyphenoxy)ethyl]-N-methylbenzamide
PubChem CID55720016
Molecular FormulaC24H26N2O4
Molecular Weight406.48 g/mol
Exact Mass406.19
IUPAC Name2-(4-methoxyanilino)-N-[2-(4-methoxyphenoxy)ethyl]-N-methylbenzamide
SMILESCOc1ccc(Nc2ccccc2C(=O)N(C)CCOc2ccc(OC)cc2)cc1
InChIInChI=1S/C24H26N2O4/c1-26(16-17-30-21-14-12-20(29-3)13-15-21)24(27)22-6-4-5-7-23(22)25-18-8-10-19(28-2)11-9-18/h4-15,25H,16-17H2,1-3H3
InChIKeyKFCWPUQKYDNBTQ-UHFFFAOYSA-N
XLogP4.60
TPSA60.03 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500406.48
LogP ≤ 54.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-cyanoethyl)-2-(4-methoxyanilino)-N-methylbenzamide
CID 60609840
N-(2-hydroxy-2-methylpropyl)-2-(4-methoxyanilino)-N-methylbenzamide
CID 111663042
2-anilino-N-[2-(2-fluorophenoxy)ethyl]-N-methylbenzamide
CID 31665595
bis[2-(4-methoxyanilino)phenyl]methanone
CID 141301142
N-[2-(3-ethynylanilino)-2-oxoethyl]-2-(4-methoxyanilino)-N-methylbenzamide
CID 55957168
4-[[2-(3-methoxyanilino)benzoyl]-methylamino]butanoic acid
CID 119173444
ethyl 2-(4-methoxyanilino)benzoate
CID 13424427
2-(4-methoxyanilino)-N-[[3-(2-methoxyethoxy)phenyl]methyl]benzamide
CID 55857881
2-hydroxy-N-[2-(4-methoxyphenoxy)ethyl]-N,5-dimethylbenzamide
CID 31284888
2-(4-methoxyanilino)-N-[3-(methylamino)propyl]benzamide
CID 119430354
5-amino-N-[2-(4-methoxyphenoxy)ethyl]-N,2-dimethylbenzamide;hydrochloride
CID 120618208
7-methoxy-N,2-dimethyl-N-(2-phenoxyethyl)quinoline-3-carboxamide
CID 27822380

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyanilino)-N-[2-(4-methoxyphenoxy)ethyl]-N-methylbenzamide?
The IUPAC name of 2-(4-methoxyanilino)-N-[2-(4-methoxyphenoxy)ethyl]-N-methylbenzamide (CID 55720016) is 2-(4-methoxyanilino)-N-[2-(4-methoxyphenoxy)ethyl]-N-methylbenzamide.
What is the SMILES notation for 2-(4-methoxyanilino)-N-[2-(4-methoxyphenoxy)ethyl]-N-methylbenzamide?
The canonical SMILES for 2-(4-methoxyanilino)-N-[2-(4-methoxyphenoxy)ethyl]-N-methylbenzamide is COc1ccc(Nc2ccccc2C(=O)N(C)CCOc2ccc(OC)cc2)cc1.
What is the InChIKey of 2-(4-methoxyanilino)-N-[2-(4-methoxyphenoxy)ethyl]-N-methylbenzamide?
The InChIKey is KFCWPUQKYDNBTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N2O4/c1-26(16-17-30-21-14-12-20(29-3)13-15-21)24(27)22-6-4-5-7-23(22)25-18-8-10-19(28-2)11-9-18/h4-15,25H,16-17H2,1-3H3.
What are the key properties of 2-(4-methoxyanilino)-N-[2-(4-methoxyphenoxy)ethyl]-N-methylbenzamide?
2-(4-methoxyanilino)-N-[2-(4-methoxyphenoxy)ethyl]-N-methylbenzamide has a molecular weight of 406.48 g/mol, XLogP of 4.60, 9 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyanilino)-N-[2-(4-methoxyphenoxy)ethyl]-N-methylbenzamide is sourced from PubChem (CID 55720016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).