2-methyl-N-[[4-(1-phenoxyethyl)phenyl]carbamoyl]benzamide

C23H22N2O3 — CID 70577786

IUPAC2-methyl-N-[[4-(1-phenoxyethyl)phenyl]carbamoyl]benzamide
SMILESCc1ccccc1C(=O)NC(=O)Nc1ccc(C(C)Oc2ccccc2)cc1
InChIInChI=1S/C23H22N2O3/c1-16-8-6-7-11-21(16)22(26)25-23(27)24-19-14-12-18(13-15-19)17(2)28-20-9-4-3-5-10-20/h3-15,17H,1-2H3,(H2,24,25,26,27)
InChIKeyZIHSAGCMDCHTDY-UHFFFAOYSA-N
MW374.44 g/mol
LogP5.10
Rot. Bonds5

About 2-methyl-N-[[4-(1-phenoxyethyl)phenyl]carbamoyl]benzamide

2-methyl-N-[[4-(1-phenoxyethyl)phenyl]carbamoyl]benzamide (PubChem CID 70577786) has the molecular formula C23H22N2O3 and a molecular weight of 374.44 g/mol. Its IUPAC name is 2-methyl-N-[[4-(1-phenoxyethyl)phenyl]carbamoyl]benzamide.

Molecular Properties

Compound Name2-methyl-N-[[4-(1-phenoxyethyl)phenyl]carbamoyl]benzamide
PubChem CID70577786
Molecular FormulaC23H22N2O3
Molecular Weight374.44 g/mol
Exact Mass374.16
IUPAC Name2-methyl-N-[[4-(1-phenoxyethyl)phenyl]carbamoyl]benzamide
SMILESCc1ccccc1C(=O)NC(=O)Nc1ccc(C(C)Oc2ccccc2)cc1
InChIInChI=1S/C23H22N2O3/c1-16-8-6-7-11-21(16)22(26)25-23(27)24-19-14-12-18(13-15-19)17(2)28-20-9-4-3-5-10-20/h3-15,17H,1-2H3,(H2,24,25,26,27)
InChIKeyZIHSAGCMDCHTDY-UHFFFAOYSA-N
XLogP5.10
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500374.44
LogP ≤ 55.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[4-[1-(4-chlorophenoxy)ethyl]phenyl]carbamoyl]-2-methylbenzamide
CID 70575711
2-methyl-N-[[4-(1-phenylpropoxy)phenyl]carbamoyl]benzamide
CID 20524502
N-[[4-[cyano(phenyl)methoxy]phenyl]carbamoyl]-2-methylbenzamide
CID 20524365
N-[[4-[1-(4-chlorophenyl)ethoxy]-3-(trifluoromethyl)phenyl]carbamoyl]-2-methylbenzamide
CID 20524556
3-chloro-N-[[4-[1-(4-chlorophenyl)ethoxy]phenyl]carbamoyl]pyridine-4-carboxamide
CID 20524484
N-[4-(1-hydroxyethyl)phenyl]-2-methylbenzamide
CID 43417161
N-[[4-(2,2-dichlorocyclopropyl)oxyphenyl]carbamoyl]-2-methylbenzamide
CID 13041497
2-methyl-N-[4-[(4-propan-2-ylbenzoyl)amino]phenyl]benzamide
CID 17251708
2-chloro-N-[[4-(2,2-dichloro-1,1-difluoroethoxy)phenyl]carbamoyl]benzamide;2-chloro-N-[[4-(1-phenylethoxy)phenyl]carbamoyl]benzamide;(3-methylphenyl) N-propylcarbamate
CID 157061486
2-methyl-N-[3-methyl-1-oxo-1-(4-propan-2-yloxyanilino)butan-2-yl]benzamide
CID 55748966
2-methyl-N-[4-(propan-2-ylamino)phenyl]benzamide
CID 112979818
2,6-difluoro-N-[[4-(1-phenylmethoxyethyl)phenyl]carbamoyl]benzamide
CID 70575675

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[[4-(1-phenoxyethyl)phenyl]carbamoyl]benzamide?
The IUPAC name of 2-methyl-N-[[4-(1-phenoxyethyl)phenyl]carbamoyl]benzamide (CID 70577786) is 2-methyl-N-[[4-(1-phenoxyethyl)phenyl]carbamoyl]benzamide.
What is the SMILES notation for 2-methyl-N-[[4-(1-phenoxyethyl)phenyl]carbamoyl]benzamide?
The canonical SMILES for 2-methyl-N-[[4-(1-phenoxyethyl)phenyl]carbamoyl]benzamide is Cc1ccccc1C(=O)NC(=O)Nc1ccc(C(C)Oc2ccccc2)cc1.
What is the InChIKey of 2-methyl-N-[[4-(1-phenoxyethyl)phenyl]carbamoyl]benzamide?
The InChIKey is ZIHSAGCMDCHTDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N2O3/c1-16-8-6-7-11-21(16)22(26)25-23(27)24-19-14-12-18(13-15-19)17(2)28-20-9-4-3-5-10-20/h3-15,17H,1-2H3,(H2,24,25,26,27).
What are the key properties of 2-methyl-N-[[4-(1-phenoxyethyl)phenyl]carbamoyl]benzamide?
2-methyl-N-[[4-(1-phenoxyethyl)phenyl]carbamoyl]benzamide has a molecular weight of 374.44 g/mol, XLogP of 5.10, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[[4-(1-phenoxyethyl)phenyl]carbamoyl]benzamide is sourced from PubChem (CID 70577786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).