N-ethyl-N-(3-methylphenyl)-3-phenoxypropanamide

C18H21NO2 — CID 113099032

IUPACN-ethyl-N-(3-methylphenyl)-3-phenoxypropanamide
SMILESCCN(C(=O)CCOc1ccccc1)c1cccc(C)c1
InChIInChI=1S/C18H21NO2/c1-3-19(16-9-7-8-15(2)14-16)18(20)12-13-21-17-10-5-4-6-11-17/h4-11,14H,3,12-13H2,1-2H3
InChIKeyANFDTWULXNIKOX-UHFFFAOYSA-N
MW283.37 g/mol
LogP3.82
Rot. Bonds6

About N-ethyl-N-(3-methylphenyl)-3-phenoxypropanamide

N-ethyl-N-(3-methylphenyl)-3-phenoxypropanamide (PubChem CID 113099032) has the molecular formula C18H21NO2 and a molecular weight of 283.37 g/mol. Its IUPAC name is N-ethyl-N-(3-methylphenyl)-3-phenoxypropanamide.

Molecular Properties

Compound NameN-ethyl-N-(3-methylphenyl)-3-phenoxypropanamide
PubChem CID113099032
Molecular FormulaC18H21NO2
Molecular Weight283.37 g/mol
Exact Mass283.16
IUPAC NameN-ethyl-N-(3-methylphenyl)-3-phenoxypropanamide
SMILESCCN(C(=O)CCOc1ccccc1)c1cccc(C)c1
InChIInChI=1S/C18H21NO2/c1-3-19(16-9-7-8-15(2)14-16)18(20)12-13-21-17-10-5-4-6-11-17/h4-11,14H,3,12-13H2,1-2H3
InChIKeyANFDTWULXNIKOX-UHFFFAOYSA-N
XLogP3.82
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.37
LogP ≤ 53.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-methylphenyl)-4-phenoxy-N-propylbutanamide
CID 17320931
3-(3-aminophenoxy)-N-ethyl-N-phenylpropanamide
CID 61090934
3-amino-N-ethyl-N-(3-methylphenyl)propanamide
CID 22692119
N-ethyl-3-(N-ethylanilino)-N-(3-methylphenyl)propanamide
CID 109036586
ethyl 4-(N-ethyl-3-methylanilino)-4-oxobutanoate
CID 60737731
3-[butyl(methyl)amino]-N-ethyl-N-(3-methylphenyl)propanamide
CID 109032470
3-[benzyl(ethyl)amino]-N-ethyl-N-(3-methylphenyl)propanamide
CID 109023151
2-(3-chlorophenoxy)-N-ethyl-N-(3-methylphenyl)acetamide
CID 112977302
N,N-dimethyl-3-(3-methylphenoxy)propanamide
CID 60637097
3-(N-ethyl-3-methylanilino)-3-oxopropane-1-sulfonyl chloride
CID 98489365
N-ethyl-N-(3-methylphenyl)-4-(4-methylphenyl)-4-oxobutanamide
CID 110295025
3-(benzenesulfonamido)-N-ethyl-N-(3-methylphenyl)propanamide
CID 17226000

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(3-methylphenyl)-3-phenoxypropanamide?
The IUPAC name of N-ethyl-N-(3-methylphenyl)-3-phenoxypropanamide (CID 113099032) is N-ethyl-N-(3-methylphenyl)-3-phenoxypropanamide.
What is the SMILES notation for N-ethyl-N-(3-methylphenyl)-3-phenoxypropanamide?
The canonical SMILES for N-ethyl-N-(3-methylphenyl)-3-phenoxypropanamide is CCN(C(=O)CCOc1ccccc1)c1cccc(C)c1.
What is the InChIKey of N-ethyl-N-(3-methylphenyl)-3-phenoxypropanamide?
The InChIKey is ANFDTWULXNIKOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO2/c1-3-19(16-9-7-8-15(2)14-16)18(20)12-13-21-17-10-5-4-6-11-17/h4-11,14H,3,12-13H2,1-2H3.
What are the key properties of N-ethyl-N-(3-methylphenyl)-3-phenoxypropanamide?
N-ethyl-N-(3-methylphenyl)-3-phenoxypropanamide has a molecular weight of 283.37 g/mol, XLogP of 3.82, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(3-methylphenyl)-3-phenoxypropanamide is sourced from PubChem (CID 113099032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).