2-[(2,6-dichlorophenyl)methoxy]-N-pyridin-3-ylbenzamide

C19H14Cl2N2O2 — CID 118911651

IUPAC2-[(2,6-dichlorophenyl)methoxy]-N-pyridin-3-ylbenzamide
SMILESO=C(Nc1cccnc1)c1ccccc1OCc1c(Cl)cccc1Cl
InChIInChI=1S/C19H14Cl2N2O2/c20-16-7-3-8-17(21)15(16)12-25-18-9-2-1-6-14(18)19(24)23-13-5-4-10-22-11-13/h1-11H,12H2,(H,23,24)
InChIKeyNKVNXCMXGNGHAB-UHFFFAOYSA-N
MW373.24 g/mol
LogP5.22
Rot. Bonds5

About 2-[(2,6-dichlorophenyl)methoxy]-N-pyridin-3-ylbenzamide

2-[(2,6-dichlorophenyl)methoxy]-N-pyridin-3-ylbenzamide (PubChem CID 118911651) has the molecular formula C19H14Cl2N2O2 and a molecular weight of 373.24 g/mol. Its IUPAC name is 2-[(2,6-dichlorophenyl)methoxy]-N-pyridin-3-ylbenzamide.

Molecular Properties

Compound Name2-[(2,6-dichlorophenyl)methoxy]-N-pyridin-3-ylbenzamide
PubChem CID118911651
Molecular FormulaC19H14Cl2N2O2
Molecular Weight373.24 g/mol
Exact Mass372.04
IUPAC Name2-[(2,6-dichlorophenyl)methoxy]-N-pyridin-3-ylbenzamide
SMILESO=C(Nc1cccnc1)c1ccccc1OCc1c(Cl)cccc1Cl
InChIInChI=1S/C19H14Cl2N2O2/c20-16-7-3-8-17(21)15(16)12-25-18-9-2-1-6-14(18)19(24)23-13-5-4-10-22-11-13/h1-11H,12H2,(H,23,24)
InChIKeyNKVNXCMXGNGHAB-UHFFFAOYSA-N
XLogP5.22
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500373.24
LogP ≤ 55.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(2,6-dichlorophenyl)methoxy]-N-pyridin-3-ylbenzamide?
The IUPAC name of 2-[(2,6-dichlorophenyl)methoxy]-N-pyridin-3-ylbenzamide (CID 118911651) is 2-[(2,6-dichlorophenyl)methoxy]-N-pyridin-3-ylbenzamide.
What is the SMILES notation for 2-[(2,6-dichlorophenyl)methoxy]-N-pyridin-3-ylbenzamide?
The canonical SMILES for 2-[(2,6-dichlorophenyl)methoxy]-N-pyridin-3-ylbenzamide is O=C(Nc1cccnc1)c1ccccc1OCc1c(Cl)cccc1Cl.
What is the InChIKey of 2-[(2,6-dichlorophenyl)methoxy]-N-pyridin-3-ylbenzamide?
The InChIKey is NKVNXCMXGNGHAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14Cl2N2O2/c20-16-7-3-8-17(21)15(16)12-25-18-9-2-1-6-14(18)19(24)23-13-5-4-10-22-11-13/h1-11H,12H2,(H,23,24).
What are the key properties of 2-[(2,6-dichlorophenyl)methoxy]-N-pyridin-3-ylbenzamide?
2-[(2,6-dichlorophenyl)methoxy]-N-pyridin-3-ylbenzamide has a molecular weight of 373.24 g/mol, XLogP of 5.22, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2,6-dichlorophenyl)methoxy]-N-pyridin-3-ylbenzamide is sourced from PubChem (CID 118911651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).