2-ethoxy-N-(4-phenylbutan-2-yl)benzamide

C19H23NO2 — CID 2914850

IUPAC2-ethoxy-N-(4-phenylbutan-2-yl)benzamide
SMILESCCOc1ccccc1C(=O)NC(C)CCc1ccccc1
InChIInChI=1S/C19H23NO2/c1-3-22-18-12-8-7-11-17(18)19(21)20-15(2)13-14-16-9-5-4-6-10-16/h4-12,15H,3,13-14H2,1-2H3,(H,20,21)
InChIKeyKTIOZUMYZKHZJU-UHFFFAOYSA-N
MW297.40 g/mol
LogP3.84
Rot. Bonds7

About 2-ethoxy-N-(4-phenylbutan-2-yl)benzamide

2-ethoxy-N-(4-phenylbutan-2-yl)benzamide (PubChem CID 2914850) has the molecular formula C19H23NO2 and a molecular weight of 297.40 g/mol. Its IUPAC name is 2-ethoxy-N-(4-phenylbutan-2-yl)benzamide.

Molecular Properties

Compound Name2-ethoxy-N-(4-phenylbutan-2-yl)benzamide
PubChem CID2914850
Molecular FormulaC19H23NO2
Molecular Weight297.40 g/mol
Exact Mass297.17
IUPAC Name2-ethoxy-N-(4-phenylbutan-2-yl)benzamide
SMILESCCOc1ccccc1C(=O)NC(C)CCc1ccccc1
InChIInChI=1S/C19H23NO2/c1-3-22-18-12-8-7-11-17(18)19(21)20-15(2)13-14-16-9-5-4-6-10-16/h4-12,15H,3,13-14H2,1-2H3,(H,20,21)
InChIKeyKTIOZUMYZKHZJU-UHFFFAOYSA-N
XLogP3.84
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-(4-phenylbutan-2-yl)benzamide?
The IUPAC name of 2-ethoxy-N-(4-phenylbutan-2-yl)benzamide (CID 2914850) is 2-ethoxy-N-(4-phenylbutan-2-yl)benzamide.
What is the SMILES notation for 2-ethoxy-N-(4-phenylbutan-2-yl)benzamide?
The canonical SMILES for 2-ethoxy-N-(4-phenylbutan-2-yl)benzamide is CCOc1ccccc1C(=O)NC(C)CCc1ccccc1.
What is the InChIKey of 2-ethoxy-N-(4-phenylbutan-2-yl)benzamide?
The InChIKey is KTIOZUMYZKHZJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO2/c1-3-22-18-12-8-7-11-17(18)19(21)20-15(2)13-14-16-9-5-4-6-10-16/h4-12,15H,3,13-14H2,1-2H3,(H,20,21).
What are the key properties of 2-ethoxy-N-(4-phenylbutan-2-yl)benzamide?
2-ethoxy-N-(4-phenylbutan-2-yl)benzamide has a molecular weight of 297.40 g/mol, XLogP of 3.84, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-(4-phenylbutan-2-yl)benzamide is sourced from PubChem (CID 2914850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).