N-[methoxy(phenyl)methyl]benzamide

C15H15NO2 — CID 569592

IUPACN-[methoxy(phenyl)methyl]benzamide
SMILESCOC(NC(=O)c1ccccc1)c1ccccc1
InChIInChI=1S/C15H15NO2/c1-18-15(13-10-6-3-7-11-13)16-14(17)12-8-4-2-5-9-12/h2-11,15H,1H3,(H,16,17)
InChIKeySMGKQBBUCCCFBY-UHFFFAOYSA-N
MW241.29 g/mol
LogP2.76
Rot. Bonds4

About N-[methoxy(phenyl)methyl]benzamide

N-[methoxy(phenyl)methyl]benzamide (PubChem CID 569592) has the molecular formula C15H15NO2 and a molecular weight of 241.29 g/mol. Its IUPAC name is N-[methoxy(phenyl)methyl]benzamide.

Molecular Properties

Compound NameN-[methoxy(phenyl)methyl]benzamide
PubChem CID569592
Molecular FormulaC15H15NO2
Molecular Weight241.29 g/mol
Exact Mass241.11
IUPAC NameN-[methoxy(phenyl)methyl]benzamide
SMILESCOC(NC(=O)c1ccccc1)c1ccccc1
InChIInChI=1S/C15H15NO2/c1-18-15(13-10-6-3-7-11-13)16-14(17)12-8-4-2-5-9-12/h2-11,15H,1H3,(H,16,17)
InChIKeySMGKQBBUCCCFBY-UHFFFAOYSA-N
XLogP2.76
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[methoxy(phenyl)methyl]benzamide?
The IUPAC name of N-[methoxy(phenyl)methyl]benzamide (CID 569592) is N-[methoxy(phenyl)methyl]benzamide.
What is the SMILES notation for N-[methoxy(phenyl)methyl]benzamide?
The canonical SMILES for N-[methoxy(phenyl)methyl]benzamide is COC(NC(=O)c1ccccc1)c1ccccc1.
What is the InChIKey of N-[methoxy(phenyl)methyl]benzamide?
The InChIKey is SMGKQBBUCCCFBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO2/c1-18-15(13-10-6-3-7-11-13)16-14(17)12-8-4-2-5-9-12/h2-11,15H,1H3,(H,16,17).
What are the key properties of N-[methoxy(phenyl)methyl]benzamide?
N-[methoxy(phenyl)methyl]benzamide has a molecular weight of 241.29 g/mol, XLogP of 2.76, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[methoxy(phenyl)methyl]benzamide is sourced from PubChem (CID 569592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).