N-(2-anilino-2-oxo-1-phenylethyl)-4-methylbenzamide

C22H20N2O2 — CID 2978047

IUPACN-(2-anilino-2-oxo-1-phenylethyl)-4-methylbenzamide
SMILESCc1ccc(C(=O)NC(C(=O)Nc2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C22H20N2O2/c1-16-12-14-18(15-13-16)21(25)24-20(17-8-4-2-5-9-17)22(26)23-19-10-6-3-7-11-19/h2-15,20H,1H3,(H,23,26)(H,24,25)
InChIKeyUGBPZROAJWLIBU-UHFFFAOYSA-N
MW344.41 g/mol
LogP4.10
Rot. Bonds5

About N-(2-anilino-2-oxo-1-phenylethyl)-4-methylbenzamide

N-(2-anilino-2-oxo-1-phenylethyl)-4-methylbenzamide (PubChem CID 2978047) has the molecular formula C22H20N2O2 and a molecular weight of 344.41 g/mol. Its IUPAC name is N-(2-anilino-2-oxo-1-phenylethyl)-4-methylbenzamide.

Molecular Properties

Compound NameN-(2-anilino-2-oxo-1-phenylethyl)-4-methylbenzamide
PubChem CID2978047
Molecular FormulaC22H20N2O2
Molecular Weight344.41 g/mol
Exact Mass344.15
IUPAC NameN-(2-anilino-2-oxo-1-phenylethyl)-4-methylbenzamide
SMILESCc1ccc(C(=O)NC(C(=O)Nc2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C22H20N2O2/c1-16-12-14-18(15-13-16)21(25)24-20(17-8-4-2-5-9-17)22(26)23-19-10-6-3-7-11-19/h2-15,20H,1H3,(H,23,26)(H,24,25)
InChIKeyUGBPZROAJWLIBU-UHFFFAOYSA-N
XLogP4.10
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.41
LogP ≤ 54.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2-anilino-2-oxo-1-phenylethyl)-4-methylbenzamide?
The IUPAC name of N-(2-anilino-2-oxo-1-phenylethyl)-4-methylbenzamide (CID 2978047) is N-(2-anilino-2-oxo-1-phenylethyl)-4-methylbenzamide.
What is the SMILES notation for N-(2-anilino-2-oxo-1-phenylethyl)-4-methylbenzamide?
The canonical SMILES for N-(2-anilino-2-oxo-1-phenylethyl)-4-methylbenzamide is Cc1ccc(C(=O)NC(C(=O)Nc2ccccc2)c2ccccc2)cc1.
What is the InChIKey of N-(2-anilino-2-oxo-1-phenylethyl)-4-methylbenzamide?
The InChIKey is UGBPZROAJWLIBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N2O2/c1-16-12-14-18(15-13-16)21(25)24-20(17-8-4-2-5-9-17)22(26)23-19-10-6-3-7-11-19/h2-15,20H,1H3,(H,23,26)(H,24,25).
What are the key properties of N-(2-anilino-2-oxo-1-phenylethyl)-4-methylbenzamide?
N-(2-anilino-2-oxo-1-phenylethyl)-4-methylbenzamide has a molecular weight of 344.41 g/mol, XLogP of 4.10, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-anilino-2-oxo-1-phenylethyl)-4-methylbenzamide is sourced from PubChem (CID 2978047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).