N-(4-ethylphenyl)-2-(4-methylphenoxy)butanamide

C19H23NO2 — CID 53286287

IUPACN-(4-ethylphenyl)-2-(4-methylphenoxy)butanamide
SMILESCCc1ccc(NC(=O)C(CC)Oc2ccc(C)cc2)cc1
InChIInChI=1S/C19H23NO2/c1-4-15-8-10-16(11-9-15)20-19(21)18(5-2)22-17-12-6-14(3)7-13-17/h6-13,18H,4-5H2,1-3H3,(H,20,21)
InChIKeyWAGNTRNECQQILO-UHFFFAOYSA-N
MW297.40 g/mol
LogP4.35
Rot. Bonds6

About N-(4-ethylphenyl)-2-(4-methylphenoxy)butanamide

N-(4-ethylphenyl)-2-(4-methylphenoxy)butanamide (PubChem CID 53286287) has the molecular formula C19H23NO2 and a molecular weight of 297.40 g/mol. Its IUPAC name is N-(4-ethylphenyl)-2-(4-methylphenoxy)butanamide.

Molecular Properties

Compound NameN-(4-ethylphenyl)-2-(4-methylphenoxy)butanamide
PubChem CID53286287
Molecular FormulaC19H23NO2
Molecular Weight297.40 g/mol
Exact Mass297.17
IUPAC NameN-(4-ethylphenyl)-2-(4-methylphenoxy)butanamide
SMILESCCc1ccc(NC(=O)C(CC)Oc2ccc(C)cc2)cc1
InChIInChI=1S/C19H23NO2/c1-4-15-8-10-16(11-9-15)20-19(21)18(5-2)22-17-12-6-14(3)7-13-17/h6-13,18H,4-5H2,1-3H3,(H,20,21)
InChIKeyWAGNTRNECQQILO-UHFFFAOYSA-N
XLogP4.35
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 54.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(4-ethylphenyl)-2-(4-methylphenoxy)butanamide?
The IUPAC name of N-(4-ethylphenyl)-2-(4-methylphenoxy)butanamide (CID 53286287) is N-(4-ethylphenyl)-2-(4-methylphenoxy)butanamide.
What is the SMILES notation for N-(4-ethylphenyl)-2-(4-methylphenoxy)butanamide?
The canonical SMILES for N-(4-ethylphenyl)-2-(4-methylphenoxy)butanamide is CCc1ccc(NC(=O)C(CC)Oc2ccc(C)cc2)cc1.
What is the InChIKey of N-(4-ethylphenyl)-2-(4-methylphenoxy)butanamide?
The InChIKey is WAGNTRNECQQILO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO2/c1-4-15-8-10-16(11-9-15)20-19(21)18(5-2)22-17-12-6-14(3)7-13-17/h6-13,18H,4-5H2,1-3H3,(H,20,21).
What are the key properties of N-(4-ethylphenyl)-2-(4-methylphenoxy)butanamide?
N-(4-ethylphenyl)-2-(4-methylphenoxy)butanamide has a molecular weight of 297.40 g/mol, XLogP of 4.35, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethylphenyl)-2-(4-methylphenoxy)butanamide is sourced from PubChem (CID 53286287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).