2-anilino-N-[1-(2,5-dimethoxyphenyl)ethyl]acetamide

C18H22N2O3 — CID 119691812

IUPAC2-anilino-N-[1-(2,5-dimethoxyphenyl)ethyl]acetamide
SMILESCOc1ccc(OC)c(C(C)NC(=O)CNc2ccccc2)c1
InChIInChI=1S/C18H22N2O3/c1-13(16-11-15(22-2)9-10-17(16)23-3)20-18(21)12-19-14-7-5-4-6-8-14/h4-11,13,19H,12H2,1-3H3,(H,20,21)
InChIKeyDFFPEZRXXZDRIZ-UHFFFAOYSA-N
MW314.38 g/mol
LogP2.99
Rot. Bonds7

About 2-anilino-N-[1-(2,5-dimethoxyphenyl)ethyl]acetamide

2-anilino-N-[1-(2,5-dimethoxyphenyl)ethyl]acetamide (PubChem CID 119691812) has the molecular formula C18H22N2O3 and a molecular weight of 314.38 g/mol. Its IUPAC name is 2-anilino-N-[1-(2,5-dimethoxyphenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-anilino-N-[1-(2,5-dimethoxyphenyl)ethyl]acetamide
PubChem CID119691812
Molecular FormulaC18H22N2O3
Molecular Weight314.38 g/mol
Exact Mass314.16
IUPAC Name2-anilino-N-[1-(2,5-dimethoxyphenyl)ethyl]acetamide
SMILESCOc1ccc(OC)c(C(C)NC(=O)CNc2ccccc2)c1
InChIInChI=1S/C18H22N2O3/c1-13(16-11-15(22-2)9-10-17(16)23-3)20-18(21)12-19-14-7-5-4-6-8-14/h4-11,13,19H,12H2,1-3H3,(H,20,21)
InChIKeyDFFPEZRXXZDRIZ-UHFFFAOYSA-N
XLogP2.99
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.38
LogP ≤ 52.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(1S)-1-(2,5-dimethoxyphenyl)ethyl]-2-phenylacetamide
CID 40553494
N-[1-(2,5-dimethoxyphenyl)ethyl]-3,3-diphenylpropanamide
CID 85019951
N-[(1R)-1-(2,5-dimethoxyphenyl)ethyl]-2-(2-fluorophenyl)acetamide
CID 9477708
N-[1-(2,5-dimethoxyphenyl)ethyl]-2-(2-methylphenyl)sulfanylacetamide
CID 51207601
2-anilino-N-[1-(3,4-dimethoxyphenyl)ethyl]acetamide;hydrochloride
CID 119720016
2-(2,5-dimethoxyphenyl)-N-[(1S)-1-(2-methoxyphenyl)ethyl]acetamide
CID 28560338
N-[(1R)-1-(2,5-dimethoxyphenyl)ethyl]-2-(4-methoxyphenyl)sulfanylacetamide
CID 9478267
N-[1-(2,5-dimethoxyphenyl)ethyl]-2-(2-methoxyethylamino)acetamide
CID 78912543
N-[(1S)-1-(2,5-dimethoxyphenyl)ethyl]-2-(4-ethylphenyl)acetamide
CID 100562771
2-(3-methoxyanilino)-N-(1-phenylethyl)acetamide
CID 54814569
N-[(1S)-1-(2,5-dimethoxyphenyl)ethyl]-2-(1,3-dioxoisoindol-2-yl)acetamide
CID 9017569
N-[1-(2,5-dimethoxyphenyl)ethyl]-3-(2-fluorophenyl)propanamide
CID 46664023

Frequently Asked Questions

What is the IUPAC name of 2-anilino-N-[1-(2,5-dimethoxyphenyl)ethyl]acetamide?
The IUPAC name of 2-anilino-N-[1-(2,5-dimethoxyphenyl)ethyl]acetamide (CID 119691812) is 2-anilino-N-[1-(2,5-dimethoxyphenyl)ethyl]acetamide.
What is the SMILES notation for 2-anilino-N-[1-(2,5-dimethoxyphenyl)ethyl]acetamide?
The canonical SMILES for 2-anilino-N-[1-(2,5-dimethoxyphenyl)ethyl]acetamide is COc1ccc(OC)c(C(C)NC(=O)CNc2ccccc2)c1.
What is the InChIKey of 2-anilino-N-[1-(2,5-dimethoxyphenyl)ethyl]acetamide?
The InChIKey is DFFPEZRXXZDRIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O3/c1-13(16-11-15(22-2)9-10-17(16)23-3)20-18(21)12-19-14-7-5-4-6-8-14/h4-11,13,19H,12H2,1-3H3,(H,20,21).
What are the key properties of 2-anilino-N-[1-(2,5-dimethoxyphenyl)ethyl]acetamide?
2-anilino-N-[1-(2,5-dimethoxyphenyl)ethyl]acetamide has a molecular weight of 314.38 g/mol, XLogP of 2.99, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-anilino-N-[1-(2,5-dimethoxyphenyl)ethyl]acetamide is sourced from PubChem (CID 119691812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).