2-[2-(3-methylanilino)-2-oxoethoxy]-N-phenylbenzamide

C22H20N2O3 — CID 2709122

IUPAC2-[2-(3-methylanilino)-2-oxoethoxy]-N-phenylbenzamide
SMILESCc1cccc(NC(=O)COc2ccccc2C(=O)Nc2ccccc2)c1
InChIInChI=1S/C22H20N2O3/c1-16-8-7-11-18(14-16)23-21(25)15-27-20-13-6-5-12-19(20)22(26)24-17-9-3-2-4-10-17/h2-14H,15H2,1H3,(H,23,25)(H,24,26)
InChIKeyJZBCSUYCNLYXHM-UHFFFAOYSA-N
MW360.41 g/mol
LogP4.26
Rot. Bonds6

About 2-[2-(3-methylanilino)-2-oxoethoxy]-N-phenylbenzamide

2-[2-(3-methylanilino)-2-oxoethoxy]-N-phenylbenzamide (PubChem CID 2709122) has the molecular formula C22H20N2O3 and a molecular weight of 360.41 g/mol. Its IUPAC name is 2-[2-(3-methylanilino)-2-oxoethoxy]-N-phenylbenzamide.

Molecular Properties

Compound Name2-[2-(3-methylanilino)-2-oxoethoxy]-N-phenylbenzamide
PubChem CID2709122
Molecular FormulaC22H20N2O3
Molecular Weight360.41 g/mol
Exact Mass360.15
IUPAC Name2-[2-(3-methylanilino)-2-oxoethoxy]-N-phenylbenzamide
SMILESCc1cccc(NC(=O)COc2ccccc2C(=O)Nc2ccccc2)c1
InChIInChI=1S/C22H20N2O3/c1-16-8-7-11-18(14-16)23-21(25)15-27-20-13-6-5-12-19(20)22(26)24-17-9-3-2-4-10-17/h2-14H,15H2,1H3,(H,23,25)(H,24,26)
InChIKeyJZBCSUYCNLYXHM-UHFFFAOYSA-N
XLogP4.26
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.41
LogP ≤ 54.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-(3,5-dimethylanilino)-2-oxoethoxy]-N-phenylbenzamide
CID 7980967
N-(3-methylphenyl)-2-(2-propanoylphenoxy)acetamide
CID 24693195
N-(3-methylphenyl)-2-(2-methylprop-2-enoxy)benzamide
CID 17130400
2-(2-methylphenoxy)-N-(3-methylphenyl)acetamide
CID 747103
2-[(3-methylphenyl)methoxy]-N-phenylbenzamide
CID 18280998
2-[[3-[[2-(2-methylphenoxy)acetyl]amino]phenyl]carbamoyl]benzoic acid
CID 3306874
3-[[2-(2-methylphenoxy)acetyl]amino]-N-(3-methylphenyl)benzamide
CID 26164549
N-[3-(2-anilino-2-oxoethoxy)phenyl]-2-methoxy-5-methylbenzamide
CID 55901703
5-bromo-2-[2-(3-methylanilino)-2-oxoethoxy]benzoic acid
CID 8707260
2-(2-acetamidophenoxy)-N-(3-methylphenyl)acetamide
CID 7867297
2-[2-(dimethylamino)ethoxy]-N-(3-methylphenyl)benzamide
CID 86991936
2-ethoxy-N-[3-[(3-methylphenyl)carbamoyl]phenyl]benzamide
CID 1228354

Frequently Asked Questions

What is the IUPAC name of 2-[2-(3-methylanilino)-2-oxoethoxy]-N-phenylbenzamide?
The IUPAC name of 2-[2-(3-methylanilino)-2-oxoethoxy]-N-phenylbenzamide (CID 2709122) is 2-[2-(3-methylanilino)-2-oxoethoxy]-N-phenylbenzamide.
What is the SMILES notation for 2-[2-(3-methylanilino)-2-oxoethoxy]-N-phenylbenzamide?
The canonical SMILES for 2-[2-(3-methylanilino)-2-oxoethoxy]-N-phenylbenzamide is Cc1cccc(NC(=O)COc2ccccc2C(=O)Nc2ccccc2)c1.
What is the InChIKey of 2-[2-(3-methylanilino)-2-oxoethoxy]-N-phenylbenzamide?
The InChIKey is JZBCSUYCNLYXHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N2O3/c1-16-8-7-11-18(14-16)23-21(25)15-27-20-13-6-5-12-19(20)22(26)24-17-9-3-2-4-10-17/h2-14H,15H2,1H3,(H,23,25)(H,24,26).
What are the key properties of 2-[2-(3-methylanilino)-2-oxoethoxy]-N-phenylbenzamide?
2-[2-(3-methylanilino)-2-oxoethoxy]-N-phenylbenzamide has a molecular weight of 360.41 g/mol, XLogP of 4.26, 6 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-phenylbenzamide is sourced from PubChem (CID 2709122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).