N-(3,4-dimethoxyphenyl)-3-(4-ethylphenyl)propanamide

C19H23NO3 — CID 41453982

IUPACN-(3,4-dimethoxyphenyl)-3-(4-ethylphenyl)propanamide
SMILESCCc1ccc(CCC(=O)Nc2ccc(OC)c(OC)c2)cc1
InChIInChI=1S/C19H23NO3/c1-4-14-5-7-15(8-6-14)9-12-19(21)20-16-10-11-17(22-2)18(13-16)23-3/h5-8,10-11,13H,4,9,12H2,1-3H3,(H,20,21)
InChIKeyILXOCSRNZRHZHA-UHFFFAOYSA-N
MW313.40 g/mol
LogP3.84
Rot. Bonds7

About N-(3,4-dimethoxyphenyl)-3-(4-ethylphenyl)propanamide

N-(3,4-dimethoxyphenyl)-3-(4-ethylphenyl)propanamide (PubChem CID 41453982) has the molecular formula C19H23NO3 and a molecular weight of 313.40 g/mol. Its IUPAC name is N-(3,4-dimethoxyphenyl)-3-(4-ethylphenyl)propanamide.

Molecular Properties

Compound NameN-(3,4-dimethoxyphenyl)-3-(4-ethylphenyl)propanamide
PubChem CID41453982
Molecular FormulaC19H23NO3
Molecular Weight313.40 g/mol
Exact Mass313.17
IUPAC NameN-(3,4-dimethoxyphenyl)-3-(4-ethylphenyl)propanamide
SMILESCCc1ccc(CCC(=O)Nc2ccc(OC)c(OC)c2)cc1
InChIInChI=1S/C19H23NO3/c1-4-14-5-7-15(8-6-14)9-12-19(21)20-16-10-11-17(22-2)18(13-16)23-3/h5-8,10-11,13H,4,9,12H2,1-3H3,(H,20,21)
InChIKeyILXOCSRNZRHZHA-UHFFFAOYSA-N
XLogP3.84
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.40
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(4-chlorophenyl)-N-(3,4-dimethoxyphenyl)propanamide
CID 19220838
3-(4-tert-butylphenyl)-N-(3,4-dimethoxyphenyl)propanamide
CID 19221168
N-(3,4-dimethoxyphenyl)-2-(4-ethylanilino)acetamide
CID 37465407
2-[2-(3,4-dimethoxyanilino)-2-oxoethyl]sulfanyl-N-(4-ethylphenyl)acetamide
CID 7731832
N-(3,4-dichlorophenyl)-3-(3,4-dimethoxyphenyl)propanamide
CID 8759873
[2-(3,4-dimethoxyanilino)-2-oxoethyl] 4-ethylbenzoate
CID 2607173
N-(3,4-dimethoxyphenyl)-3-hydroxypropanamide
CID 94259640
N,N'-bis(3,4-dimethoxyphenyl)propanediamide
CID 21232287
3-(3,4-dimethoxyphenyl)-N-(3-fluoro-4-methylphenyl)propanamide
CID 9215674
3-(3,4-dimethoxyphenyl)-N-(4-ethylsulfonylphenyl)propanamide
CID 42021780
3-(2,6-dimethoxyphenyl)-N-(4-ethylphenyl)propanamide
CID 100789404
3-(3,4-dimethoxyphenyl)-N-(4-phenylphenyl)propanamide
CID 8880797

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dimethoxyphenyl)-3-(4-ethylphenyl)propanamide?
The IUPAC name of N-(3,4-dimethoxyphenyl)-3-(4-ethylphenyl)propanamide (CID 41453982) is N-(3,4-dimethoxyphenyl)-3-(4-ethylphenyl)propanamide.
What is the SMILES notation for N-(3,4-dimethoxyphenyl)-3-(4-ethylphenyl)propanamide?
The canonical SMILES for N-(3,4-dimethoxyphenyl)-3-(4-ethylphenyl)propanamide is CCc1ccc(CCC(=O)Nc2ccc(OC)c(OC)c2)cc1.
What is the InChIKey of N-(3,4-dimethoxyphenyl)-3-(4-ethylphenyl)propanamide?
The InChIKey is ILXOCSRNZRHZHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO3/c1-4-14-5-7-15(8-6-14)9-12-19(21)20-16-10-11-17(22-2)18(13-16)23-3/h5-8,10-11,13H,4,9,12H2,1-3H3,(H,20,21).
What are the key properties of N-(3,4-dimethoxyphenyl)-3-(4-ethylphenyl)propanamide?
N-(3,4-dimethoxyphenyl)-3-(4-ethylphenyl)propanamide has a molecular weight of 313.40 g/mol, XLogP of 3.84, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dimethoxyphenyl)-3-(4-ethylphenyl)propanamide is sourced from PubChem (CID 41453982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).