2-[2-(3-methylanilino)-2-oxoethoxy]-N-(1-phenylethyl)benzamide

C24H24N2O3 — CID 2994220

IUPAC2-[2-(3-methylanilino)-2-oxoethoxy]-N-(1-phenylethyl)benzamide
SMILESCc1cccc(NC(=O)COc2ccccc2C(=O)NC(C)c2ccccc2)c1
InChIInChI=1S/C24H24N2O3/c1-17-9-8-12-20(15-17)26-23(27)16-29-22-14-7-6-13-21(22)24(28)25-18(2)19-10-4-3-5-11-19/h3-15,18H,16H2,1-2H3,(H,25,28)(H,26,27)
InChIKeyQZDHEWGTASJOAW-UHFFFAOYSA-N
MW388.47 g/mol
LogP4.50
Rot. Bonds7

About 2-[2-(3-methylanilino)-2-oxoethoxy]-N-(1-phenylethyl)benzamide

2-[2-(3-methylanilino)-2-oxoethoxy]-N-(1-phenylethyl)benzamide (PubChem CID 2994220) has the molecular formula C24H24N2O3 and a molecular weight of 388.47 g/mol. Its IUPAC name is 2-[2-(3-methylanilino)-2-oxoethoxy]-N-(1-phenylethyl)benzamide.

Molecular Properties

Compound Name2-[2-(3-methylanilino)-2-oxoethoxy]-N-(1-phenylethyl)benzamide
PubChem CID2994220
Molecular FormulaC24H24N2O3
Molecular Weight388.47 g/mol
Exact Mass388.18
IUPAC Name2-[2-(3-methylanilino)-2-oxoethoxy]-N-(1-phenylethyl)benzamide
SMILESCc1cccc(NC(=O)COc2ccccc2C(=O)NC(C)c2ccccc2)c1
InChIInChI=1S/C24H24N2O3/c1-17-9-8-12-20(15-17)26-23(27)16-29-22-14-7-6-13-21(22)24(28)25-18(2)19-10-4-3-5-11-19/h3-15,18H,16H2,1-2H3,(H,25,28)(H,26,27)
InChIKeyQZDHEWGTASJOAW-UHFFFAOYSA-N
XLogP4.50
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.47
LogP ≤ 54.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(3-methylanilino)-2-oxoethoxy]-N-(1-phenylethyl)benzamide?
The IUPAC name of 2-[2-(3-methylanilino)-2-oxoethoxy]-N-(1-phenylethyl)benzamide (CID 2994220) is 2-[2-(3-methylanilino)-2-oxoethoxy]-N-(1-phenylethyl)benzamide.
What is the SMILES notation for 2-[2-(3-methylanilino)-2-oxoethoxy]-N-(1-phenylethyl)benzamide?
The canonical SMILES for 2-[2-(3-methylanilino)-2-oxoethoxy]-N-(1-phenylethyl)benzamide is Cc1cccc(NC(=O)COc2ccccc2C(=O)NC(C)c2ccccc2)c1.
What is the InChIKey of 2-[2-(3-methylanilino)-2-oxoethoxy]-N-(1-phenylethyl)benzamide?
The InChIKey is QZDHEWGTASJOAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N2O3/c1-17-9-8-12-20(15-17)26-23(27)16-29-22-14-7-6-13-21(22)24(28)25-18(2)19-10-4-3-5-11-19/h3-15,18H,16H2,1-2H3,(H,25,28)(H,26,27).
What are the key properties of 2-[2-(3-methylanilino)-2-oxoethoxy]-N-(1-phenylethyl)benzamide?
2-[2-(3-methylanilino)-2-oxoethoxy]-N-(1-phenylethyl)benzamide has a molecular weight of 388.47 g/mol, XLogP of 4.50, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(3-methylanilino)-2-oxoethoxy]-N-(1-phenylethyl)benzamide is sourced from PubChem (CID 2994220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).