5-methoxy-2-phenylmethoxy-N-pyridin-3-ylbenzamide

C20H18N2O3 — CID 67107081

IUPAC5-methoxy-2-phenylmethoxy-N-pyridin-3-ylbenzamide
SMILESCOc1ccc(OCc2ccccc2)c(C(=O)Nc2cccnc2)c1
InChIInChI=1S/C20H18N2O3/c1-24-17-9-10-19(25-14-15-6-3-2-4-7-15)18(12-17)20(23)22-16-8-5-11-21-13-16/h2-13H,14H2,1H3,(H,22,23)
InChIKeyGXCORBHGAGBVSF-UHFFFAOYSA-N
MW334.38 g/mol
LogP3.92
Rot. Bonds6

About 5-methoxy-2-phenylmethoxy-N-pyridin-3-ylbenzamide

5-methoxy-2-phenylmethoxy-N-pyridin-3-ylbenzamide (PubChem CID 67107081) has the molecular formula C20H18N2O3 and a molecular weight of 334.38 g/mol. Its IUPAC name is 5-methoxy-2-phenylmethoxy-N-pyridin-3-ylbenzamide.

Molecular Properties

Compound Name5-methoxy-2-phenylmethoxy-N-pyridin-3-ylbenzamide
PubChem CID67107081
Molecular FormulaC20H18N2O3
Molecular Weight334.38 g/mol
Exact Mass334.13
IUPAC Name5-methoxy-2-phenylmethoxy-N-pyridin-3-ylbenzamide
SMILESCOc1ccc(OCc2ccccc2)c(C(=O)Nc2cccnc2)c1
InChIInChI=1S/C20H18N2O3/c1-24-17-9-10-19(25-14-15-6-3-2-4-7-15)18(12-17)20(23)22-16-8-5-11-21-13-16/h2-13H,14H2,1H3,(H,22,23)
InChIKeyGXCORBHGAGBVSF-UHFFFAOYSA-N
XLogP3.92
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.38
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-((2-ethylphenyl)methoxy)-N-(pyridin-3-yl)benzamide
CID 118911741
(3R,4R)-N-{4-[4-(2-Fluoro-6-hydroxy-3-methoxy-benzoyl)-benzyloxy]-azepan-3-YL}-isonicotinamide
CID 657016
4-fluoro-3-[2-(4-fluorophenyl)ethoxy]-N-{[1-(pyridin-4-yl)piperidin-4-yl]methyl}benzamide
CID 23396290
4-fluoro-3-[2-(4-methoxyphenyl)ethoxy]-N-{[1-(pyridin-4-yl)piperidin-4-yl]methyl}benzamide
CID 23396291
4-fluoro-3-[2-(4-methylphenyl)ethoxy]-N-{[1-(pyridin-4-yl)piperidin-4-yl]methyl}benzamide
CID 23396292
5-(4-Methylpiperazin-1-Yl)-2-Phenylmethoxy-~{n}-Pyridin-3-Yl-Benzamide
CID 51357515
2-(benzyloxy)-5-(2-fluoropyridin-4-yl)-N-(pyridin-3-yl)benzamide
CID 68107965
N-[(3-methoxyphenyl)methyl]-5H-[1]benzopyrano[3,4-c]pyridine-8-carboxamide
CID 121363591
N-Methyl-N-((2-(1-(2-(methylamino)ethyl)piperidin-4-yl)pyridin-4-yl)methyl)-3-phenoxybenzamide
CID 122707126
2-Methoxy-4-[4-methyl-5-(4-piperazin-1-ylphenyl)pyridin-3-yl]benzamide
CID 139582022
ROCK inhibitor-2
CID 51003130
N-[(1R)-1-(3-methoxyphenyl)ethyl]-5H-chromeno[3,4-c]pyridine-8-carboxamide
CID 86764444

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-2-phenylmethoxy-N-pyridin-3-ylbenzamide?
The IUPAC name of 5-methoxy-2-phenylmethoxy-N-pyridin-3-ylbenzamide (CID 67107081) is 5-methoxy-2-phenylmethoxy-N-pyridin-3-ylbenzamide.
What is the SMILES notation for 5-methoxy-2-phenylmethoxy-N-pyridin-3-ylbenzamide?
The canonical SMILES for 5-methoxy-2-phenylmethoxy-N-pyridin-3-ylbenzamide is COc1ccc(OCc2ccccc2)c(C(=O)Nc2cccnc2)c1.
What is the InChIKey of 5-methoxy-2-phenylmethoxy-N-pyridin-3-ylbenzamide?
The InChIKey is GXCORBHGAGBVSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N2O3/c1-24-17-9-10-19(25-14-15-6-3-2-4-7-15)18(12-17)20(23)22-16-8-5-11-21-13-16/h2-13H,14H2,1H3,(H,22,23).
What are the key properties of 5-methoxy-2-phenylmethoxy-N-pyridin-3-ylbenzamide?
5-methoxy-2-phenylmethoxy-N-pyridin-3-ylbenzamide has a molecular weight of 334.38 g/mol, XLogP of 3.92, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-2-phenylmethoxy-N-pyridin-3-ylbenzamide is sourced from PubChem (CID 67107081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).