3-(3,4-dimethoxyphenyl)-N-(2,6-dimethylphenyl)propanamide

C19H23NO3 — CID 19220644

IUPAC3-(3,4-dimethoxyphenyl)-N-(2,6-dimethylphenyl)propanamide
SMILESCOc1ccc(CCC(=O)Nc2c(C)cccc2C)cc1OC
InChIInChI=1S/C19H23NO3/c1-13-6-5-7-14(2)19(13)20-18(21)11-9-15-8-10-16(22-3)17(12-15)23-4/h5-8,10,12H,9,11H2,1-4H3,(H,20,21)
InChIKeyGKIAAEUIVREZAQ-UHFFFAOYSA-N
MW313.40 g/mol
LogP3.89
Rot. Bonds6

About 3-(3,4-dimethoxyphenyl)-N-(2,6-dimethylphenyl)propanamide

3-(3,4-dimethoxyphenyl)-N-(2,6-dimethylphenyl)propanamide (PubChem CID 19220644) has the molecular formula C19H23NO3 and a molecular weight of 313.40 g/mol. Its IUPAC name is 3-(3,4-dimethoxyphenyl)-N-(2,6-dimethylphenyl)propanamide.

Molecular Properties

Compound Name3-(3,4-dimethoxyphenyl)-N-(2,6-dimethylphenyl)propanamide
PubChem CID19220644
Molecular FormulaC19H23NO3
Molecular Weight313.40 g/mol
Exact Mass313.17
IUPAC Name3-(3,4-dimethoxyphenyl)-N-(2,6-dimethylphenyl)propanamide
SMILESCOc1ccc(CCC(=O)Nc2c(C)cccc2C)cc1OC
InChIInChI=1S/C19H23NO3/c1-13-6-5-7-14(2)19(13)20-18(21)11-9-15-8-10-16(22-3)17(12-15)23-4/h5-8,10,12H,9,11H2,1-4H3,(H,20,21)
InChIKeyGKIAAEUIVREZAQ-UHFFFAOYSA-N
XLogP3.89
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.40
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(2,6-difluoroanilino)-2-oxoethyl]-3-(3,4-dimethoxyphenyl)propanamide
CID 113002282
3-(3,4-dimethoxyphenyl)-N-[2-(2,3-dimethylanilino)-2-oxoethyl]propanamide
CID 26660572
N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(2,6-dimethylanilino)propanamide
CID 109027750
3-(3,4-dimethoxyphenyl)-N-(2-hydroxyphenyl)propanamide
CID 12822107
3-(3,4-dimethoxyphenyl)-N-(2-methoxy-5-methylphenyl)propanamide
CID 2684730
3-(3,4-dimethoxyphenyl)-N-(4,5-dimethylthiophen-2-yl)propanamide
CID 110660107
N-(3-bromophenyl)-3-(3,4-dimethoxyphenyl)propanamide
CID 9341227
3-(3,4-dichlorophenyl)-N-(2,6-dimethylphenyl)propanamide
CID 100593249
N-(4-chloro-2-methoxy-5-methylphenyl)-3-(3,4-dimethoxyphenyl)propanamide
CID 4799937
3-(3,4-dimethoxyphenyl)-N-(3-fluoro-4-methylphenyl)propanamide
CID 9215674
2-(3,4-dimethoxyphenyl)ethyl-[(2S)-1-[[2-(2,6-dimethylanilino)-2-oxoethyl]amino]-1-oxopropan-2-yl]-methylazanium
CID 9036100
3-(3,4-dimethoxyphenyl)-N-(4-phenylphenyl)propanamide
CID 8880797

Frequently Asked Questions

What is the IUPAC name of 3-(3,4-dimethoxyphenyl)-N-(2,6-dimethylphenyl)propanamide?
The IUPAC name of 3-(3,4-dimethoxyphenyl)-N-(2,6-dimethylphenyl)propanamide (CID 19220644) is 3-(3,4-dimethoxyphenyl)-N-(2,6-dimethylphenyl)propanamide.
What is the SMILES notation for 3-(3,4-dimethoxyphenyl)-N-(2,6-dimethylphenyl)propanamide?
The canonical SMILES for 3-(3,4-dimethoxyphenyl)-N-(2,6-dimethylphenyl)propanamide is COc1ccc(CCC(=O)Nc2c(C)cccc2C)cc1OC.
What is the InChIKey of 3-(3,4-dimethoxyphenyl)-N-(2,6-dimethylphenyl)propanamide?
The InChIKey is GKIAAEUIVREZAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO3/c1-13-6-5-7-14(2)19(13)20-18(21)11-9-15-8-10-16(22-3)17(12-15)23-4/h5-8,10,12H,9,11H2,1-4H3,(H,20,21).
What are the key properties of 3-(3,4-dimethoxyphenyl)-N-(2,6-dimethylphenyl)propanamide?
3-(3,4-dimethoxyphenyl)-N-(2,6-dimethylphenyl)propanamide has a molecular weight of 313.40 g/mol, XLogP of 3.89, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,4-dimethoxyphenyl)-N-(2,6-dimethylphenyl)propanamide is sourced from PubChem (CID 19220644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).