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

C23H24N2O4 — CID 60520684

IUPAC3,4-diethoxy-N-[3-(pyridin-3-ylmethoxy)phenyl]benzamide
SMILESCCOc1ccc(C(=O)Nc2cccc(OCc3cccnc3)c2)cc1OCC
InChIInChI=1S/C23H24N2O4/c1-3-27-21-11-10-18(13-22(21)28-4-2)23(26)25-19-8-5-9-20(14-19)29-16-17-7-6-12-24-15-17/h5-15H,3-4,16H2,1-2H3,(H,25,26)
InChIKeyWMGZLTIXFJAABE-UHFFFAOYSA-N
MW392.46 g/mol
LogP4.71
Rot. Bonds9

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

3,4-diethoxy-N-[3-(pyridin-3-ylmethoxy)phenyl]benzamide (PubChem CID 60520684) has the molecular formula C23H24N2O4 and a molecular weight of 392.46 g/mol. Its IUPAC name is 3,4-diethoxy-N-[3-(pyridin-3-ylmethoxy)phenyl]benzamide.

Molecular Properties

Compound Name3,4-diethoxy-N-[3-(pyridin-3-ylmethoxy)phenyl]benzamide
PubChem CID60520684
Molecular FormulaC23H24N2O4
Molecular Weight392.46 g/mol
Exact Mass392.17
IUPAC Name3,4-diethoxy-N-[3-(pyridin-3-ylmethoxy)phenyl]benzamide
SMILESCCOc1ccc(C(=O)Nc2cccc(OCc3cccnc3)c2)cc1OCC
InChIInChI=1S/C23H24N2O4/c1-3-27-21-11-10-18(13-22(21)28-4-2)23(26)25-19-8-5-9-20(14-19)29-16-17-7-6-12-24-15-17/h5-15H,3-4,16H2,1-2H3,(H,25,26)
InChIKeyWMGZLTIXFJAABE-UHFFFAOYSA-N
XLogP4.71
TPSA69.68 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.46
LogP ≤ 54.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-ethoxy-N-(3-fluorophenyl)-4-(pyridin-3-ylmethoxy)benzamide
CID 39111619
3,4-diethoxy-N-[4-methoxy-3-(pyridin-3-ylmethoxy)phenyl]benzamide
CID 46426672
3-ethoxy-N-(3-nitrophenyl)-4-(pyridin-3-ylmethoxy)benzamide
CID 39269336
4-methylsulfanyl-N-[3-(pyridin-3-ylmethoxy)phenyl]benzamide
CID 78890950
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-ethoxy-4-(pyridin-3-ylmethoxy)benzamide
CID 55578633
N'-[3-ethoxy-4-(pyridin-3-ylmethoxy)benzoyl]pyridine-3-carbohydrazide
CID 39270460
3-ethoxy-N-[3-(2-pyrazol-1-ylpropanoylamino)phenyl]-4-(pyridin-3-ylmethoxy)benzamide
CID 46440691
4-ethoxy-N'-[3-ethoxy-4-(pyridin-3-ylmethoxy)benzoyl]-3-methoxybenzohydrazide
CID 30837646
N-(5-acetamido-2-methoxyphenyl)-3-ethoxy-4-(pyridin-3-ylmethoxy)benzamide
CID 39106187
N'-[3-ethoxy-4-(pyridin-3-ylmethoxy)benzoyl]-3,4-dimethoxybenzohydrazide
CID 55576480
N-(3-fluoro-4-methoxyphenyl)-3-(pyridin-3-ylmethoxy)benzamide
CID 55796689
N-(2-butoxyphenyl)-3-ethoxy-4-(pyridin-3-ylmethoxy)benzamide
CID 55953832

Frequently Asked Questions

What is the IUPAC name of 3,4-diethoxy-N-[3-(pyridin-3-ylmethoxy)phenyl]benzamide?
The IUPAC name of 3,4-diethoxy-N-[3-(pyridin-3-ylmethoxy)phenyl]benzamide (CID 60520684) is 3,4-diethoxy-N-[3-(pyridin-3-ylmethoxy)phenyl]benzamide.
What is the SMILES notation for 3,4-diethoxy-N-[3-(pyridin-3-ylmethoxy)phenyl]benzamide?
The canonical SMILES for 3,4-diethoxy-N-[3-(pyridin-3-ylmethoxy)phenyl]benzamide is CCOc1ccc(C(=O)Nc2cccc(OCc3cccnc3)c2)cc1OCC.
What is the InChIKey of 3,4-diethoxy-N-[3-(pyridin-3-ylmethoxy)phenyl]benzamide?
The InChIKey is WMGZLTIXFJAABE-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O4/c1-3-27-21-11-10-18(13-22(21)28-4-2)23(26)25-19-8-5-9-20(14-19)29-16-17-7-6-12-24-15-17/h5-15H,3-4,16H2,1-2H3,(H,25,26).
What are the key properties of 3,4-diethoxy-N-[3-(pyridin-3-ylmethoxy)phenyl]benzamide?
3,4-diethoxy-N-[3-(pyridin-3-ylmethoxy)phenyl]benzamide has a molecular weight of 392.46 g/mol, XLogP of 4.71, 9 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-diethoxy-N-[3-(pyridin-3-ylmethoxy)phenyl]benzamide is sourced from PubChem (CID 60520684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).