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

C26H22N2O2 — CID 60521820

IUPAC3-phenylmethoxy-N-[phenyl(pyridin-4-yl)methyl]benzamide
SMILESO=C(NC(c1ccccc1)c1ccncc1)c1cccc(OCc2ccccc2)c1
InChIInChI=1S/C26H22N2O2/c29-26(23-12-7-13-24(18-23)30-19-20-8-3-1-4-9-20)28-25(21-10-5-2-6-11-21)22-14-16-27-17-15-22/h1-18,25H,19H2,(H,28,29)
InChIKeyFEKIPJLTKHLBRW-UHFFFAOYSA-N
MW394.47 g/mol
LogP5.18
Rot. Bonds7

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

3-phenylmethoxy-N-[phenyl(pyridin-4-yl)methyl]benzamide (PubChem CID 60521820) has the molecular formula C26H22N2O2 and a molecular weight of 394.47 g/mol. Its IUPAC name is 3-phenylmethoxy-N-[phenyl(pyridin-4-yl)methyl]benzamide.

Molecular Properties

Compound Name3-phenylmethoxy-N-[phenyl(pyridin-4-yl)methyl]benzamide
PubChem CID60521820
Molecular FormulaC26H22N2O2
Molecular Weight394.47 g/mol
Exact Mass394.17
IUPAC Name3-phenylmethoxy-N-[phenyl(pyridin-4-yl)methyl]benzamide
SMILESO=C(NC(c1ccccc1)c1ccncc1)c1cccc(OCc2ccccc2)c1
InChIInChI=1S/C26H22N2O2/c29-26(23-12-7-13-24(18-23)30-19-20-8-3-1-4-9-20)28-25(21-10-5-2-6-11-21)22-14-16-27-17-15-22/h1-18,25H,19H2,(H,28,29)
InChIKeyFEKIPJLTKHLBRW-UHFFFAOYSA-N
XLogP5.18
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 ≤ 55.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(R)-(1-methylimidazol-2-yl)-phenylmethyl]-3-phenylmethoxybenzamide
CID 25390282
3-phenylmethoxy-N-[(1S)-1-phenylpropyl]benzamide
CID 93234582
N-(3,4-dichlorophenyl)-3-phenylmethoxybenzamide
CID 17148514
3-phenyl-2-[[3-(pyridin-3-ylmethoxy)benzoyl]amino]butanoic acid
CID 146099183
5-[(3-bromophenoxy)methyl]-N-[phenyl(pyridin-4-yl)methyl]furan-2-carboxamide
CID 55773602
3-[(2-chlorophenyl)methoxy]-N-[(4-methylphenyl)-phenylmethyl]benzamide
CID 133189944
3-[(2-chlorophenyl)methoxy]-N-[(R)-(4-methylphenyl)-phenylmethyl]benzamide
CID 100749590
N-[phenyl(thiophen-2-yl)methyl]-3-(1,3-thiazol-4-ylmethoxy)benzamide
CID 24682427
(2S)-4-phenyl-2-[[3-(pyridin-3-ylmethoxy)benzoyl]amino]butanoic acid
CID 146099236
3-[(2-chlorophenyl)methoxy]-N-[(R)-(3-methylphenyl)-phenylmethyl]benzamide
CID 100749901
3-ethoxy-N-[(1R)-1-pyridin-4-ylethyl]benzamide
CID 40637184
N-[(1S)-1-(4-methoxyphenyl)propyl]-3-phenylmethoxybenzamide
CID 38005412

Frequently Asked Questions

What is the IUPAC name of 3-phenylmethoxy-N-[phenyl(pyridin-4-yl)methyl]benzamide?
The IUPAC name of 3-phenylmethoxy-N-[phenyl(pyridin-4-yl)methyl]benzamide (CID 60521820) is 3-phenylmethoxy-N-[phenyl(pyridin-4-yl)methyl]benzamide.
What is the SMILES notation for 3-phenylmethoxy-N-[phenyl(pyridin-4-yl)methyl]benzamide?
The canonical SMILES for 3-phenylmethoxy-N-[phenyl(pyridin-4-yl)methyl]benzamide is O=C(NC(c1ccccc1)c1ccncc1)c1cccc(OCc2ccccc2)c1.
What is the InChIKey of 3-phenylmethoxy-N-[phenyl(pyridin-4-yl)methyl]benzamide?
The InChIKey is FEKIPJLTKHLBRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H22N2O2/c29-26(23-12-7-13-24(18-23)30-19-20-8-3-1-4-9-20)28-25(21-10-5-2-6-11-21)22-14-16-27-17-15-22/h1-18,25H,19H2,(H,28,29).
What are the key properties of 3-phenylmethoxy-N-[phenyl(pyridin-4-yl)methyl]benzamide?
3-phenylmethoxy-N-[phenyl(pyridin-4-yl)methyl]benzamide has a molecular weight of 394.47 g/mol, XLogP of 5.18, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenylmethoxy-N-[phenyl(pyridin-4-yl)methyl]benzamide is sourced from PubChem (CID 60521820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).