3-(2,6-diethylanilino)-N-(2-methoxyphenyl)propanamide

C20H26N2O2 — CID 109037115

IUPAC3-(2,6-diethylanilino)-N-(2-methoxyphenyl)propanamide
SMILESCCc1cccc(CC)c1NCCC(=O)Nc1ccccc1OC
InChIInChI=1S/C20H26N2O2/c1-4-15-9-8-10-16(5-2)20(15)21-14-13-19(23)22-17-11-6-7-12-18(17)24-3/h6-12,21H,4-5,13-14H2,1-3H3,(H,22,23)
InChIKeyOIEIKKDBXKRYPT-UHFFFAOYSA-N
MW326.44 g/mol
LogP4.26
Rot. Bonds8

About 3-(2,6-diethylanilino)-N-(2-methoxyphenyl)propanamide

3-(2,6-diethylanilino)-N-(2-methoxyphenyl)propanamide (PubChem CID 109037115) has the molecular formula C20H26N2O2 and a molecular weight of 326.44 g/mol. Its IUPAC name is 3-(2,6-diethylanilino)-N-(2-methoxyphenyl)propanamide.

Molecular Properties

Compound Name3-(2,6-diethylanilino)-N-(2-methoxyphenyl)propanamide
PubChem CID109037115
Molecular FormulaC20H26N2O2
Molecular Weight326.44 g/mol
Exact Mass326.20
IUPAC Name3-(2,6-diethylanilino)-N-(2-methoxyphenyl)propanamide
SMILESCCc1cccc(CC)c1NCCC(=O)Nc1ccccc1OC
InChIInChI=1S/C20H26N2O2/c1-4-15-9-8-10-16(5-2)20(15)21-14-13-19(23)22-17-11-6-7-12-18(17)24-3/h6-12,21H,4-5,13-14H2,1-3H3,(H,22,23)
InChIKeyOIEIKKDBXKRYPT-UHFFFAOYSA-N
XLogP4.26
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.44
LogP ≤ 54.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(2-ethyl-6-methylanilino)-N-(2-methoxyphenyl)propanamide
CID 109036653
3-(2-ethyl-6-methylanilino)-N-(2-propan-2-yloxyphenyl)propanamide
CID 109036659
N-(2-methoxyphenyl)-3-(methylamino)propanamide
CID 54773589
N-(2,6-diethylphenyl)-3-(2,5-dimethoxyanilino)propanamide
CID 109037085
N,3-bis(2-methoxyphenyl)propanamide
CID 17394407
N-(2,3-dimethylphenyl)-3-(2-methoxyanilino)propanamide
CID 8893151
N'-(2-ethyl-6-methylphenyl)-N-(2-methoxyphenyl)ethane-1,2-diamine
CID 54810086
3-(4-bromoanilino)-N-(2-methoxyphenyl)propanamide
CID 109039232
N-(2-methoxyphenyl)-3-[(2-methylphenyl)methylamino]propanamide
CID 109019344
3-(2,6-difluoroanilino)-N-(2-ethoxyphenyl)propanamide
CID 109039796
N-(2,6-diethylphenyl)-3-(2-methoxyphenyl)propanamide
CID 51143891
3-(2-ethyl-6-methylanilino)-N-[(2-methoxyphenyl)methyl]propanamide
CID 109022011

Frequently Asked Questions

What is the IUPAC name of 3-(2,6-diethylanilino)-N-(2-methoxyphenyl)propanamide?
The IUPAC name of 3-(2,6-diethylanilino)-N-(2-methoxyphenyl)propanamide (CID 109037115) is 3-(2,6-diethylanilino)-N-(2-methoxyphenyl)propanamide.
What is the SMILES notation for 3-(2,6-diethylanilino)-N-(2-methoxyphenyl)propanamide?
The canonical SMILES for 3-(2,6-diethylanilino)-N-(2-methoxyphenyl)propanamide is CCc1cccc(CC)c1NCCC(=O)Nc1ccccc1OC.
What is the InChIKey of 3-(2,6-diethylanilino)-N-(2-methoxyphenyl)propanamide?
The InChIKey is OIEIKKDBXKRYPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O2/c1-4-15-9-8-10-16(5-2)20(15)21-14-13-19(23)22-17-11-6-7-12-18(17)24-3/h6-12,21H,4-5,13-14H2,1-3H3,(H,22,23).
What are the key properties of 3-(2,6-diethylanilino)-N-(2-methoxyphenyl)propanamide?
3-(2,6-diethylanilino)-N-(2-methoxyphenyl)propanamide has a molecular weight of 326.44 g/mol, XLogP of 4.26, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,6-diethylanilino)-N-(2-methoxyphenyl)propanamide is sourced from PubChem (CID 109037115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).