N-(3,4-dimethoxyphenyl)-2-(4-ethylanilino)acetamide

C18H22N2O3 — CID 37465407

IUPACN-(3,4-dimethoxyphenyl)-2-(4-ethylanilino)acetamide
SMILESCCc1ccc(NCC(=O)Nc2ccc(OC)c(OC)c2)cc1
InChIInChI=1S/C18H22N2O3/c1-4-13-5-7-14(8-6-13)19-12-18(21)20-15-9-10-16(22-2)17(11-15)23-3/h5-11,19H,4,12H2,1-3H3,(H,20,21)
InChIKeyREJCRLSDNWMXBE-UHFFFAOYSA-N
MW314.39 g/mol
LogP3.32
Rot. Bonds7

About N-(3,4-dimethoxyphenyl)-2-(4-ethylanilino)acetamide

N-(3,4-dimethoxyphenyl)-2-(4-ethylanilino)acetamide (PubChem CID 37465407) has the molecular formula C18H22N2O3 and a molecular weight of 314.39 g/mol. Its IUPAC name is N-(3,4-dimethoxyphenyl)-2-(4-ethylanilino)acetamide.

Molecular Properties

Compound NameN-(3,4-dimethoxyphenyl)-2-(4-ethylanilino)acetamide
PubChem CID37465407
Molecular FormulaC18H22N2O3
Molecular Weight314.39 g/mol
Exact Mass314.16
IUPAC NameN-(3,4-dimethoxyphenyl)-2-(4-ethylanilino)acetamide
SMILESCCc1ccc(NCC(=O)Nc2ccc(OC)c(OC)c2)cc1
InChIInChI=1S/C18H22N2O3/c1-4-13-5-7-14(8-6-13)19-12-18(21)20-15-9-10-16(22-2)17(11-15)23-3/h5-11,19H,4,12H2,1-3H3,(H,20,21)
InChIKeyREJCRLSDNWMXBE-UHFFFAOYSA-N
XLogP3.32
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.39
LogP ≤ 53.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

ethyl 4-[[2-(3,4-dimethoxyanilino)-2-oxoethyl]amino]benzoate
CID 109009646
N-(3,4-dimethoxyphenyl)-2-(4-ethoxyanilino)acetamide
CID 109009183
N-(3,4-dimethoxyphenyl)-3-(4-ethylphenyl)propanamide
CID 41453982
2-[2-(3,4-dimethoxyanilino)-2-oxoethyl]sulfanyl-N-(4-ethylphenyl)acetamide
CID 7731832
2-(4-cyanoanilino)-N-(3,4-dimethoxyphenyl)acetamide
CID 26437501
N-(3-chloro-4-methoxyphenyl)-2-(3,4-dimethoxyanilino)acetamide
CID 109008835
[2-(3,4-dimethoxyanilino)-2-oxoethyl] 4-ethylbenzoate
CID 2607173
N-(3,4-difluorophenyl)-2-(3,4-dimethoxyanilino)acetamide
CID 109009628
2-(3,4-dichloroanilino)-N-(3,4-dimethoxyphenyl)acetamide
CID 9098792
2-(4,5-dimethoxy-2-methylanilino)-N-(3,4-dimethoxyphenyl)acetamide
CID 9105356
N,N'-bis(3,4-dimethoxyphenyl)propanediamide
CID 21232287
2-(4-bromo-3-methylanilino)-N-(3,4-dimethoxyphenyl)acetamide
CID 9099482

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dimethoxyphenyl)-2-(4-ethylanilino)acetamide?
The IUPAC name of N-(3,4-dimethoxyphenyl)-2-(4-ethylanilino)acetamide (CID 37465407) is N-(3,4-dimethoxyphenyl)-2-(4-ethylanilino)acetamide.
What is the SMILES notation for N-(3,4-dimethoxyphenyl)-2-(4-ethylanilino)acetamide?
The canonical SMILES for N-(3,4-dimethoxyphenyl)-2-(4-ethylanilino)acetamide is CCc1ccc(NCC(=O)Nc2ccc(OC)c(OC)c2)cc1.
What is the InChIKey of N-(3,4-dimethoxyphenyl)-2-(4-ethylanilino)acetamide?
The InChIKey is REJCRLSDNWMXBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O3/c1-4-13-5-7-14(8-6-13)19-12-18(21)20-15-9-10-16(22-2)17(11-15)23-3/h5-11,19H,4,12H2,1-3H3,(H,20,21).
What are the key properties of N-(3,4-dimethoxyphenyl)-2-(4-ethylanilino)acetamide?
N-(3,4-dimethoxyphenyl)-2-(4-ethylanilino)acetamide has a molecular weight of 314.39 g/mol, XLogP of 3.32, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dimethoxyphenyl)-2-(4-ethylanilino)acetamide is sourced from PubChem (CID 37465407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).