3-(3,5-dimethoxyphenyl)-2-ethylbenzamide

C17H19NO3 — CID 68986880

IUPAC3-(3,5-dimethoxyphenyl)-2-ethylbenzamide
SMILESCCc1c(C(N)=O)cccc1-c1cc(OC)cc(OC)c1
InChIInChI=1S/C17H19NO3/c1-4-14-15(6-5-7-16(14)17(18)19)11-8-12(20-2)10-13(9-11)21-3/h5-10H,4H2,1-3H3,(H2,18,19)
InChIKeyPDGFWGNCQZVURQ-UHFFFAOYSA-N
MW285.34 g/mol
LogP3.03
Rot. Bonds5

About 3-(3,5-dimethoxyphenyl)-2-ethylbenzamide

3-(3,5-dimethoxyphenyl)-2-ethylbenzamide (PubChem CID 68986880) has the molecular formula C17H19NO3 and a molecular weight of 285.34 g/mol. Its IUPAC name is 3-(3,5-dimethoxyphenyl)-2-ethylbenzamide.

Molecular Properties

Compound Name3-(3,5-dimethoxyphenyl)-2-ethylbenzamide
PubChem CID68986880
Molecular FormulaC17H19NO3
Molecular Weight285.34 g/mol
Exact Mass285.14
IUPAC Name3-(3,5-dimethoxyphenyl)-2-ethylbenzamide
SMILESCCc1c(C(N)=O)cccc1-c1cc(OC)cc(OC)c1
InChIInChI=1S/C17H19NO3/c1-4-14-15(6-5-7-16(14)17(18)19)11-8-12(20-2)10-13(9-11)21-3/h5-10H,4H2,1-3H3,(H2,18,19)
InChIKeyPDGFWGNCQZVURQ-UHFFFAOYSA-N
XLogP3.03
TPSA61.55 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.34
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-ethyl-3-pyrimidin-5-ylbenzamide
CID 166652738
4-(3,5-dimethoxyphenyl)-2-ethylbenzene-1,3-dicarboxylic acid
CID 172834763
2-ethyl-3-(1H-indol-6-yl)benzamide
CID 68637689
2,3-diethylbenzamide;hydrofluoride
CID 175203586
3-amino-2-ethylbenzamide;dihydrochloride
CID 174785201
2-ethyl-3-[2-(trifluoromethyl)-3-pyridinyl]benzamide
CID 126655093
2-(3,5-dimethoxyphenyl)-N-propan-2-ylbenzamide
CID 72846372
1,3,5-trimethoxybenzene;urea
CID 174919725
3-amino-2-(3,5-dimethoxyanilino)benzamide
CID 115933905
2-ethyl-3-methoxybenzenecarbothioamide
CID 91875220
2-(3-amino-5-methoxyphenoxy)benzamide
CID 80747937
2-[(1R)-1-(3-methoxyphenyl)ethyl]benzene-1,3-dicarboxamide
CID 68727161

Frequently Asked Questions

What is the IUPAC name of 3-(3,5-dimethoxyphenyl)-2-ethylbenzamide?
The IUPAC name of 3-(3,5-dimethoxyphenyl)-2-ethylbenzamide (CID 68986880) is 3-(3,5-dimethoxyphenyl)-2-ethylbenzamide.
What is the SMILES notation for 3-(3,5-dimethoxyphenyl)-2-ethylbenzamide?
The canonical SMILES for 3-(3,5-dimethoxyphenyl)-2-ethylbenzamide is CCc1c(C(N)=O)cccc1-c1cc(OC)cc(OC)c1.
What is the InChIKey of 3-(3,5-dimethoxyphenyl)-2-ethylbenzamide?
The InChIKey is PDGFWGNCQZVURQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO3/c1-4-14-15(6-5-7-16(14)17(18)19)11-8-12(20-2)10-13(9-11)21-3/h5-10H,4H2,1-3H3,(H2,18,19).
What are the key properties of 3-(3,5-dimethoxyphenyl)-2-ethylbenzamide?
3-(3,5-dimethoxyphenyl)-2-ethylbenzamide has a molecular weight of 285.34 g/mol, XLogP of 3.03, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,5-dimethoxyphenyl)-2-ethylbenzamide is sourced from PubChem (CID 68986880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).