N-(3,4-dimethylphenyl)-3-(2-ethylanilino)propanamide

C19H24N2O — CID 109035425

IUPACN-(3,4-dimethylphenyl)-3-(2-ethylanilino)propanamide
SMILESCCc1ccccc1NCCC(=O)Nc1ccc(C)c(C)c1
InChIInChI=1S/C19H24N2O/c1-4-16-7-5-6-8-18(16)20-12-11-19(22)21-17-10-9-14(2)15(3)13-17/h5-10,13,20H,4,11-12H2,1-3H3,(H,21,22)
InChIKeyOFMVIERTFWTENX-UHFFFAOYSA-N
MW296.41 g/mol
LogP4.31
Rot. Bonds6

About N-(3,4-dimethylphenyl)-3-(2-ethylanilino)propanamide

N-(3,4-dimethylphenyl)-3-(2-ethylanilino)propanamide (PubChem CID 109035425) has the molecular formula C19H24N2O and a molecular weight of 296.41 g/mol. Its IUPAC name is N-(3,4-dimethylphenyl)-3-(2-ethylanilino)propanamide.

Molecular Properties

Compound NameN-(3,4-dimethylphenyl)-3-(2-ethylanilino)propanamide
PubChem CID109035425
Molecular FormulaC19H24N2O
Molecular Weight296.41 g/mol
Exact Mass296.19
IUPAC NameN-(3,4-dimethylphenyl)-3-(2-ethylanilino)propanamide
SMILESCCc1ccccc1NCCC(=O)Nc1ccc(C)c(C)c1
InChIInChI=1S/C19H24N2O/c1-4-16-7-5-6-8-18(16)20-12-11-19(22)21-17-10-9-14(2)15(3)13-17/h5-10,13,20H,4,11-12H2,1-3H3,(H,21,22)
InChIKeyOFMVIERTFWTENX-UHFFFAOYSA-N
XLogP4.31
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.41
LogP ≤ 54.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3,4-dimethylphenyl)-3-(2-methylanilino)propanamide
CID 109034069
3-(2-bromoanilino)-N-(3,4-dimethylphenyl)propanamide
CID 109035478
N-(3,4-dimethylphenyl)-3-(2-propan-2-ylanilino)propanamide
CID 109035429
N-(3,5-dichlorophenyl)-3-(2-ethylanilino)propanamide
CID 109036245
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(2-ethylanilino)propanamide
CID 109036236
N-(2,4-dimethylphenyl)-3-(2-ethylanilino)propanamide
CID 109035079
3-(2-ethylanilino)-N-[3-(trifluoromethyl)phenyl]propanamide
CID 109036212
N-(3-bromo-4-methylphenyl)-3-(2-methylanilino)propanamide
CID 109034087
3-(3,4-dimethylanilino)-N-(2-ethoxyphenyl)propanamide
CID 109035537
3-(2-ethylanilino)-N-(4-piperidin-1-ylphenyl)propanamide
CID 109036225
3-(4-bromoanilino)-N-(3,4-dimethylphenyl)propanamide
CID 109035446
N-(3-acetamidophenyl)-3-(2-methylanilino)propanamide
CID 51149887

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dimethylphenyl)-3-(2-ethylanilino)propanamide?
The IUPAC name of N-(3,4-dimethylphenyl)-3-(2-ethylanilino)propanamide (CID 109035425) is N-(3,4-dimethylphenyl)-3-(2-ethylanilino)propanamide.
What is the SMILES notation for N-(3,4-dimethylphenyl)-3-(2-ethylanilino)propanamide?
The canonical SMILES for N-(3,4-dimethylphenyl)-3-(2-ethylanilino)propanamide is CCc1ccccc1NCCC(=O)Nc1ccc(C)c(C)c1.
What is the InChIKey of N-(3,4-dimethylphenyl)-3-(2-ethylanilino)propanamide?
The InChIKey is OFMVIERTFWTENX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O/c1-4-16-7-5-6-8-18(16)20-12-11-19(22)21-17-10-9-14(2)15(3)13-17/h5-10,13,20H,4,11-12H2,1-3H3,(H,21,22).
What are the key properties of N-(3,4-dimethylphenyl)-3-(2-ethylanilino)propanamide?
N-(3,4-dimethylphenyl)-3-(2-ethylanilino)propanamide has a molecular weight of 296.41 g/mol, XLogP of 4.31, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dimethylphenyl)-3-(2-ethylanilino)propanamide is sourced from PubChem (CID 109035425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).