2-benzyl-N-[(6-methoxy-3-pyridinyl)methyl]benzamide

C21H20N2O2 — CID 51316857

IUPAC2-benzyl-N-[(6-methoxy-3-pyridinyl)methyl]benzamide
SMILESCOc1ccc(CNC(=O)c2ccccc2Cc2ccccc2)cn1
InChIInChI=1S/C21H20N2O2/c1-25-20-12-11-17(14-22-20)15-23-21(24)19-10-6-5-9-18(19)13-16-7-3-2-4-8-16/h2-12,14H,13,15H2,1H3,(H,23,24)
InChIKeyZNEGNGBIPYIEQL-UHFFFAOYSA-N
MW332.40 g/mol
LogP3.61
Rot. Bonds6

About 2-benzyl-N-[(6-methoxy-3-pyridinyl)methyl]benzamide

2-benzyl-N-[(6-methoxy-3-pyridinyl)methyl]benzamide (PubChem CID 51316857) has the molecular formula C21H20N2O2 and a molecular weight of 332.40 g/mol. Its IUPAC name is 2-benzyl-N-[(6-methoxy-3-pyridinyl)methyl]benzamide.

Molecular Properties

Compound Name2-benzyl-N-[(6-methoxy-3-pyridinyl)methyl]benzamide
PubChem CID51316857
Molecular FormulaC21H20N2O2
Molecular Weight332.40 g/mol
Exact Mass332.15
IUPAC Name2-benzyl-N-[(6-methoxy-3-pyridinyl)methyl]benzamide
SMILESCOc1ccc(CNC(=O)c2ccccc2Cc2ccccc2)cn1
InChIInChI=1S/C21H20N2O2/c1-25-20-12-11-17(14-22-20)15-23-21(24)19-10-6-5-9-18(19)13-16-7-3-2-4-8-16/h2-12,14H,13,15H2,1H3,(H,23,24)
InChIKeyZNEGNGBIPYIEQL-UHFFFAOYSA-N
XLogP3.61
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.40
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-[(6-methoxy-3-pyridinyl)methyl]benzamide
CID 61250537
N-[(6-methoxy-3-pyridinyl)methyl]-4-phenylbenzamide
CID 24589971
1-N,4-N-bis[(6-methoxy-3-pyridinyl)methyl]benzene-1,4-dicarboxamide
CID 24646071
4-[[(2-benzylbenzoyl)amino]methyl]benzoic acid
CID 45426449
2-benzyl-N-[[3-(2-methoxyethoxy)phenyl]methyl]benzamide
CID 55801218
N-[(6-methoxy-3-pyridinyl)methyl]-6-methyl-4-(methylamino)pyridine-3-carboxamide
CID 81239641
methyl 2-[(2-benzylbenzoyl)amino]acetate
CID 78800072
2,5-difluoro-N-[(6-methoxy-3-pyridinyl)methyl]benzamide
CID 47136692
2,4-difluoro-N-[(6-methoxy-3-pyridinyl)methyl]benzamide
CID 47136619
1-benzyl-3-[(6-methoxy-3-pyridinyl)methyl]-2-methylguanidine
CID 110954680
N-[(6-methoxy-3-pyridinyl)methyl]-2-oxo-1H-quinoline-3-carboxamide
CID 16613259
N-[3-[(6-methoxy-3-pyridinyl)methylamino]-3-oxopropyl]benzamide
CID 16602215

Frequently Asked Questions

What is the IUPAC name of 2-benzyl-N-[(6-methoxy-3-pyridinyl)methyl]benzamide?
The IUPAC name of 2-benzyl-N-[(6-methoxy-3-pyridinyl)methyl]benzamide (CID 51316857) is 2-benzyl-N-[(6-methoxy-3-pyridinyl)methyl]benzamide.
What is the SMILES notation for 2-benzyl-N-[(6-methoxy-3-pyridinyl)methyl]benzamide?
The canonical SMILES for 2-benzyl-N-[(6-methoxy-3-pyridinyl)methyl]benzamide is COc1ccc(CNC(=O)c2ccccc2Cc2ccccc2)cn1.
What is the InChIKey of 2-benzyl-N-[(6-methoxy-3-pyridinyl)methyl]benzamide?
The InChIKey is ZNEGNGBIPYIEQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N2O2/c1-25-20-12-11-17(14-22-20)15-23-21(24)19-10-6-5-9-18(19)13-16-7-3-2-4-8-16/h2-12,14H,13,15H2,1H3,(H,23,24).
What are the key properties of 2-benzyl-N-[(6-methoxy-3-pyridinyl)methyl]benzamide?
2-benzyl-N-[(6-methoxy-3-pyridinyl)methyl]benzamide has a molecular weight of 332.40 g/mol, XLogP of 3.61, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzyl-N-[(6-methoxy-3-pyridinyl)methyl]benzamide is sourced from PubChem (CID 51316857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).