N-(3,5-dimethylphenyl)-N-ethyl-3-phenylpropanamide

C19H23NO — CID 52574490

IUPACN-(3,5-dimethylphenyl)-N-ethyl-3-phenylpropanamide
SMILESCCN(C(=O)CCc1ccccc1)c1cc(C)cc(C)c1
InChIInChI=1S/C19H23NO/c1-4-20(18-13-15(2)12-16(3)14-18)19(21)11-10-17-8-6-5-7-9-17/h5-9,12-14H,4,10-11H2,1-3H3
InChIKeyQPPCUXHZAOBHMF-UHFFFAOYSA-N
MW281.40 g/mol
LogP4.29
Rot. Bonds5

About N-(3,5-dimethylphenyl)-N-ethyl-3-phenylpropanamide

N-(3,5-dimethylphenyl)-N-ethyl-3-phenylpropanamide (PubChem CID 52574490) has the molecular formula C19H23NO and a molecular weight of 281.40 g/mol. Its IUPAC name is N-(3,5-dimethylphenyl)-N-ethyl-3-phenylpropanamide.

Molecular Properties

Compound NameN-(3,5-dimethylphenyl)-N-ethyl-3-phenylpropanamide
PubChem CID52574490
Molecular FormulaC19H23NO
Molecular Weight281.40 g/mol
Exact Mass281.18
IUPAC NameN-(3,5-dimethylphenyl)-N-ethyl-3-phenylpropanamide
SMILESCCN(C(=O)CCc1ccccc1)c1cc(C)cc(C)c1
InChIInChI=1S/C19H23NO/c1-4-20(18-13-15(2)12-16(3)14-18)19(21)11-10-17-8-6-5-7-9-17/h5-9,12-14H,4,10-11H2,1-3H3
InChIKeyQPPCUXHZAOBHMF-UHFFFAOYSA-N
XLogP4.29
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 54.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-(3,5-dimethylphenyl)-N-ethyl-2-phenylacetamide
CID 55592045
3-(2-aminophenyl)-N-(3,5-dimethylphenyl)-N-ethylpropanamide
CID 120609604
4-[3-(N-ethylanilino)-3-oxopropyl]benzoic acid
CID 82071678
N-(3,5-dimethylphenyl)-N-ethylbenzamide
CID 52574489
N-ethyl-N-(5-hydroxy-2-methylphenyl)-3-phenylpropanamide
CID 28740208
N-(3,5-dimethylphenyl)-N-ethyl-3-(1,3-thiazol-2-yl)propanamide
CID 75417005
3-[benzyl(ethyl)amino]-N-ethyl-N-(3-methylphenyl)propanamide
CID 109023151
[2-(N-ethylanilino)-2-oxoethyl] 3-phenylpropanoate
CID 2391741
N-ethyl-3-(N-ethylanilino)-N-(3-methylphenyl)propanamide
CID 109036586
N-ethyl-N-(3-methylphenyl)-2-[methylsulfonyl(2-phenylethyl)amino]acetamide
CID 113151893
3-amino-N-ethyl-N-(3-methylphenyl)propanamide
CID 22692119
3-[3-amino-4-(diethylamino)phenyl]-N-ethyl-N-phenylpropanamide
CID 39131020

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethylphenyl)-N-ethyl-3-phenylpropanamide?
The IUPAC name of N-(3,5-dimethylphenyl)-N-ethyl-3-phenylpropanamide (CID 52574490) is N-(3,5-dimethylphenyl)-N-ethyl-3-phenylpropanamide.
What is the SMILES notation for N-(3,5-dimethylphenyl)-N-ethyl-3-phenylpropanamide?
The canonical SMILES for N-(3,5-dimethylphenyl)-N-ethyl-3-phenylpropanamide is CCN(C(=O)CCc1ccccc1)c1cc(C)cc(C)c1.
What is the InChIKey of N-(3,5-dimethylphenyl)-N-ethyl-3-phenylpropanamide?
The InChIKey is QPPCUXHZAOBHMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO/c1-4-20(18-13-15(2)12-16(3)14-18)19(21)11-10-17-8-6-5-7-9-17/h5-9,12-14H,4,10-11H2,1-3H3.
What are the key properties of N-(3,5-dimethylphenyl)-N-ethyl-3-phenylpropanamide?
N-(3,5-dimethylphenyl)-N-ethyl-3-phenylpropanamide has a molecular weight of 281.40 g/mol, XLogP of 4.29, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethylphenyl)-N-ethyl-3-phenylpropanamide is sourced from PubChem (CID 52574490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).