N-methyl-4-phenoxy-N-(2-pyridin-2-ylethyl)benzamide

C21H20N2O2 — CID 78796251

IUPACN-methyl-4-phenoxy-N-(2-pyridin-2-ylethyl)benzamide
SMILESCN(CCc1ccccn1)C(=O)c1ccc(Oc2ccccc2)cc1
InChIInChI=1S/C21H20N2O2/c1-23(16-14-18-7-5-6-15-22-18)21(24)17-10-12-20(13-11-17)25-19-8-3-2-4-9-19/h2-13,15H,14,16H2,1H3
InChIKeyUHCIAPYQYOPQFR-UHFFFAOYSA-N
MW332.40 g/mol
LogP4.19
Rot. Bonds6

About N-methyl-4-phenoxy-N-(2-pyridin-2-ylethyl)benzamide

N-methyl-4-phenoxy-N-(2-pyridin-2-ylethyl)benzamide (PubChem CID 78796251) has the molecular formula C21H20N2O2 and a molecular weight of 332.40 g/mol. Its IUPAC name is N-methyl-4-phenoxy-N-(2-pyridin-2-ylethyl)benzamide.

Molecular Properties

Compound NameN-methyl-4-phenoxy-N-(2-pyridin-2-ylethyl)benzamide
PubChem CID78796251
Molecular FormulaC21H20N2O2
Molecular Weight332.40 g/mol
Exact Mass332.15
IUPAC NameN-methyl-4-phenoxy-N-(2-pyridin-2-ylethyl)benzamide
SMILESCN(CCc1ccccn1)C(=O)c1ccc(Oc2ccccc2)cc1
InChIInChI=1S/C21H20N2O2/c1-23(16-14-18-7-5-6-15-22-18)21(24)17-10-12-20(13-11-17)25-19-8-3-2-4-9-19/h2-13,15H,14,16H2,1H3
InChIKeyUHCIAPYQYOPQFR-UHFFFAOYSA-N
XLogP4.19
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.40
LogP ≤ 54.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-ethoxy-N-methyl-N-(2-pyridin-2-ylethyl)benzamide
CID 56809954
4-fluoro-N-methyl-N-(2-pyridin-2-ylethyl)benzamide;oxalic acid
CID 90483378
phenyl N-methyl-N-(2-pyridin-2-ylethyl)carbamate
CID 60681158
6-bromo-N-methyl-N-(2-pyridin-2-ylethyl)pyridine-3-carboxamide
CID 66463680
2-[methyl(2-pyridin-2-ylethyl)amino]-2-oxoacetic acid
CID 43445021
N-methyl-4-[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]-N-(2-pyridin-2-ylethyl)benzamide
CID 134008705
N-methyl-N-(2-pyridin-2-ylethyl)-3-sulfanylbenzamide
CID 107021824
3-iodo-N-methyl-N-(2-pyridin-2-ylethyl)benzamide
CID 60653685
3-bromo-4-fluoro-N-methyl-N-(2-pyridin-2-ylethyl)benzamide
CID 103707127
2-cyano-N-methyl-N-(2-pyridin-2-ylethyl)pyridine-4-carboxamide
CID 115115934
3-bromo-4-chloro-N-methyl-N-(2-pyridin-2-ylethyl)benzamide
CID 103841475
ethane;N-methyl-N-(2-pyridin-2-ylethyl)acetamide
CID 143678158

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-phenoxy-N-(2-pyridin-2-ylethyl)benzamide?
The IUPAC name of N-methyl-4-phenoxy-N-(2-pyridin-2-ylethyl)benzamide (CID 78796251) is N-methyl-4-phenoxy-N-(2-pyridin-2-ylethyl)benzamide.
What is the SMILES notation for N-methyl-4-phenoxy-N-(2-pyridin-2-ylethyl)benzamide?
The canonical SMILES for N-methyl-4-phenoxy-N-(2-pyridin-2-ylethyl)benzamide is CN(CCc1ccccn1)C(=O)c1ccc(Oc2ccccc2)cc1.
What is the InChIKey of N-methyl-4-phenoxy-N-(2-pyridin-2-ylethyl)benzamide?
The InChIKey is UHCIAPYQYOPQFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N2O2/c1-23(16-14-18-7-5-6-15-22-18)21(24)17-10-12-20(13-11-17)25-19-8-3-2-4-9-19/h2-13,15H,14,16H2,1H3.
What are the key properties of N-methyl-4-phenoxy-N-(2-pyridin-2-ylethyl)benzamide?
N-methyl-4-phenoxy-N-(2-pyridin-2-ylethyl)benzamide has a molecular weight of 332.40 g/mol, XLogP of 4.19, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-phenoxy-N-(2-pyridin-2-ylethyl)benzamide is sourced from PubChem (CID 78796251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).