4-phenyl-N-[[4-(pyridin-3-ylmethoxy)phenyl]methyl]benzamide

C26H22N2O2 — CID 46476162

IUPAC4-phenyl-N-[[4-(pyridin-3-ylmethoxy)phenyl]methyl]benzamide
SMILESO=C(NCc1ccc(OCc2cccnc2)cc1)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C26H22N2O2/c29-26(24-12-10-23(11-13-24)22-6-2-1-3-7-22)28-18-20-8-14-25(15-9-20)30-19-21-5-4-16-27-17-21/h1-17H,18-19H2,(H,28,29)
InChIKeyGZFFPMDPNHPVDY-UHFFFAOYSA-N
MW394.47 g/mol
LogP5.26
Rot. Bonds7

About 4-phenyl-N-[[4-(pyridin-3-ylmethoxy)phenyl]methyl]benzamide

4-phenyl-N-[[4-(pyridin-3-ylmethoxy)phenyl]methyl]benzamide (PubChem CID 46476162) has the molecular formula C26H22N2O2 and a molecular weight of 394.47 g/mol. Its IUPAC name is 4-phenyl-N-[[4-(pyridin-3-ylmethoxy)phenyl]methyl]benzamide.

Molecular Properties

Compound Name4-phenyl-N-[[4-(pyridin-3-ylmethoxy)phenyl]methyl]benzamide
PubChem CID46476162
Molecular FormulaC26H22N2O2
Molecular Weight394.47 g/mol
Exact Mass394.17
IUPAC Name4-phenyl-N-[[4-(pyridin-3-ylmethoxy)phenyl]methyl]benzamide
SMILESO=C(NCc1ccc(OCc2cccnc2)cc1)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C26H22N2O2/c29-26(24-12-10-23(11-13-24)22-6-2-1-3-7-22)28-18-20-8-14-25(15-9-20)30-19-21-5-4-16-27-17-21/h1-17H,18-19H2,(H,28,29)
InChIKeyGZFFPMDPNHPVDY-UHFFFAOYSA-N
XLogP5.26
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500394.47
LogP ≤ 55.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(4-phenylmethoxyphenyl)methyl]pyridine-3-carboxamide
CID 23130542
4-(dimethylsulfamoyl)-N-[[4-(pyridin-3-ylmethoxy)phenyl]methyl]benzamide
CID 55708038
N-[(3,5-dimethoxyphenyl)methyl]-4-(pyridin-3-ylmethoxy)benzamide
CID 46590121
N-[(4-fluoro-3-methylphenyl)methyl]-4-(pyridin-3-ylmethoxy)benzamide
CID 39697713
4-(5-methylpyrazol-1-yl)-N-[[4-(pyridin-3-ylmethoxy)phenyl]methyl]benzamide
CID 55708042
3,4,5-trimethoxy-N-[[4-(pyridin-3-ylmethoxy)phenyl]methyl]benzamide
CID 55708070
N-(2-anilino-2-oxoethyl)-4-(pyridin-3-ylmethoxy)benzamide
CID 166190877
4-ethoxy-N-(pyridin-3-ylmethyl)benzamide
CID 673607
N-[3-oxo-1-phenyl-3-[[4-(pyridin-3-ylmethoxy)phenyl]methylamino]propyl]benzamide
CID 55707958
4-(pyridin-3-ylmethoxy)-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]benzamide
CID 30853061
N-[[4-(pyridin-3-ylmethoxy)phenyl]methyl]-4-(thiophen-2-ylsulfonylamino)benzamide
CID 46466645
4-chloro-N-[[4-(pyridin-3-ylmethoxy)phenyl]methyl]pyridine-2-carboxamide
CID 86990543

Frequently Asked Questions

What is the IUPAC name of 4-phenyl-N-[[4-(pyridin-3-ylmethoxy)phenyl]methyl]benzamide?
The IUPAC name of 4-phenyl-N-[[4-(pyridin-3-ylmethoxy)phenyl]methyl]benzamide (CID 46476162) is 4-phenyl-N-[[4-(pyridin-3-ylmethoxy)phenyl]methyl]benzamide.
What is the SMILES notation for 4-phenyl-N-[[4-(pyridin-3-ylmethoxy)phenyl]methyl]benzamide?
The canonical SMILES for 4-phenyl-N-[[4-(pyridin-3-ylmethoxy)phenyl]methyl]benzamide is O=C(NCc1ccc(OCc2cccnc2)cc1)c1ccc(-c2ccccc2)cc1.
What is the InChIKey of 4-phenyl-N-[[4-(pyridin-3-ylmethoxy)phenyl]methyl]benzamide?
The InChIKey is GZFFPMDPNHPVDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H22N2O2/c29-26(24-12-10-23(11-13-24)22-6-2-1-3-7-22)28-18-20-8-14-25(15-9-20)30-19-21-5-4-16-27-17-21/h1-17H,18-19H2,(H,28,29).
What are the key properties of 4-phenyl-N-[[4-(pyridin-3-ylmethoxy)phenyl]methyl]benzamide?
4-phenyl-N-[[4-(pyridin-3-ylmethoxy)phenyl]methyl]benzamide has a molecular weight of 394.47 g/mol, XLogP of 5.26, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenyl-N-[[4-(pyridin-3-ylmethoxy)phenyl]methyl]benzamide is sourced from PubChem (CID 46476162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).