N-(3,4-dimethylphenyl)-3-(N-ethylanilino)propanamide

C19H24N2O — CID 109035427

IUPACN-(3,4-dimethylphenyl)-3-(N-ethylanilino)propanamide
SMILESCCN(CCC(=O)Nc1ccc(C)c(C)c1)c1ccccc1
InChIInChI=1S/C19H24N2O/c1-4-21(18-8-6-5-7-9-18)13-12-19(22)20-17-11-10-15(2)16(3)14-17/h5-11,14H,4,12-13H2,1-3H3,(H,20,22)
InChIKeyTUERLFKHIAWIFQ-UHFFFAOYSA-N
MW296.41 g/mol
LogP4.16
Rot. Bonds6

About N-(3,4-dimethylphenyl)-3-(N-ethylanilino)propanamide

N-(3,4-dimethylphenyl)-3-(N-ethylanilino)propanamide (PubChem CID 109035427) has the molecular formula C19H24N2O and a molecular weight of 296.41 g/mol. Its IUPAC name is N-(3,4-dimethylphenyl)-3-(N-ethylanilino)propanamide.

Molecular Properties

Compound NameN-(3,4-dimethylphenyl)-3-(N-ethylanilino)propanamide
PubChem CID109035427
Molecular FormulaC19H24N2O
Molecular Weight296.41 g/mol
Exact Mass296.19
IUPAC NameN-(3,4-dimethylphenyl)-3-(N-ethylanilino)propanamide
SMILESCCN(CCC(=O)Nc1ccc(C)c(C)c1)c1ccccc1
InChIInChI=1S/C19H24N2O/c1-4-21(18-8-6-5-7-9-18)13-12-19(22)20-17-11-10-15(2)16(3)14-17/h5-11,14H,4,12-13H2,1-3H3,(H,20,22)
InChIKeyTUERLFKHIAWIFQ-UHFFFAOYSA-N
XLogP4.16
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.41
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3,4-dimethylphenyl)-3-(N-methylanilino)propanamide
CID 109034636
3-[N-acetyl-4-(diethylamino)anilino]-N-(3,4-dimethylphenyl)propanamide
CID 113131889
N-(3,4-dimethylphenyl)-3-(N-methylsulfonylanilino)propanamide
CID 113141510
N-(3,4-dimethylphenyl)-3-(dipropylamino)propanamide
CID 109033116
N-(4-bromo-2-methylphenyl)-3-(N-ethylanilino)propanamide
CID 109036567
N-[4-(diethylamino)phenyl]-2-(3,4-dimethylanilino)acetamide
CID 109007429
N-(3,4-dimethoxyphenyl)-3-(N-ethyl-3-methylanilino)propanamide
CID 109040578
N-(3,4-dimethylphenyl)-3-[[(3R)-3-hydroxy-3-phenylpropyl]-methylamino]propanamide
CID 124749856
N-(3,4-dimethylphenyl)-3-[methylsulfonyl(3-phenylpropyl)amino]propanamide
CID 113140730
N-(3,4-dimethylphenyl)-4-oxo-4-[2-(phenylcarbamoyl)hydrazinyl]butanamide
CID 2377822
3-(N-ethylanilino)-N-(2-methyl-6-propan-2-ylphenyl)propanamide
CID 109036517
N-(2,4-dichlorophenyl)-3-(N-ethylanilino)propanamide
CID 109036579

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dimethylphenyl)-3-(N-ethylanilino)propanamide?
The IUPAC name of N-(3,4-dimethylphenyl)-3-(N-ethylanilino)propanamide (CID 109035427) is N-(3,4-dimethylphenyl)-3-(N-ethylanilino)propanamide.
What is the SMILES notation for N-(3,4-dimethylphenyl)-3-(N-ethylanilino)propanamide?
The canonical SMILES for N-(3,4-dimethylphenyl)-3-(N-ethylanilino)propanamide is CCN(CCC(=O)Nc1ccc(C)c(C)c1)c1ccccc1.
What is the InChIKey of N-(3,4-dimethylphenyl)-3-(N-ethylanilino)propanamide?
The InChIKey is TUERLFKHIAWIFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O/c1-4-21(18-8-6-5-7-9-18)13-12-19(22)20-17-11-10-15(2)16(3)14-17/h5-11,14H,4,12-13H2,1-3H3,(H,20,22).
What are the key properties of N-(3,4-dimethylphenyl)-3-(N-ethylanilino)propanamide?
N-(3,4-dimethylphenyl)-3-(N-ethylanilino)propanamide has a molecular weight of 296.41 g/mol, XLogP of 4.16, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dimethylphenyl)-3-(N-ethylanilino)propanamide is sourced from PubChem (CID 109035427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).