N-[methoxy(dipyridin-2-yl)methyl]benzamide

C19H17N3O2 — CID 123194279

IUPACN-[methoxy(dipyridin-2-yl)methyl]benzamide
SMILESCOC(NC(=O)c1ccccc1)(c1ccccn1)c1ccccn1
InChIInChI=1S/C19H17N3O2/c1-24-19(16-11-5-7-13-20-16,17-12-6-8-14-21-17)22-18(23)15-9-3-2-4-10-15/h2-14H,1H3,(H,22,23)
InChIKeyGSYSOFKJNCCQQG-UHFFFAOYSA-N
MW319.36 g/mol
LogP2.75
Rot. Bonds5

About N-[methoxy(dipyridin-2-yl)methyl]benzamide

N-[methoxy(dipyridin-2-yl)methyl]benzamide (PubChem CID 123194279) has the molecular formula C19H17N3O2 and a molecular weight of 319.36 g/mol. Its IUPAC name is N-[methoxy(dipyridin-2-yl)methyl]benzamide.

Molecular Properties

Compound NameN-[methoxy(dipyridin-2-yl)methyl]benzamide
PubChem CID123194279
Molecular FormulaC19H17N3O2
Molecular Weight319.36 g/mol
Exact Mass319.13
IUPAC NameN-[methoxy(dipyridin-2-yl)methyl]benzamide
SMILESCOC(NC(=O)c1ccccc1)(c1ccccn1)c1ccccn1
InChIInChI=1S/C19H17N3O2/c1-24-19(16-11-5-7-13-20-16,17-12-6-8-14-21-17)22-18(23)15-9-3-2-4-10-15/h2-14H,1H3,(H,22,23)
InChIKeyGSYSOFKJNCCQQG-UHFFFAOYSA-N
XLogP2.75
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.36
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

Analyze N-[methoxy(dipyridin-2-yl)methyl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[methoxy(dipyridin-2-yl)methyl]benzamide?
The IUPAC name of N-[methoxy(dipyridin-2-yl)methyl]benzamide (CID 123194279) is N-[methoxy(dipyridin-2-yl)methyl]benzamide.
What is the SMILES notation for N-[methoxy(dipyridin-2-yl)methyl]benzamide?
The canonical SMILES for N-[methoxy(dipyridin-2-yl)methyl]benzamide is COC(NC(=O)c1ccccc1)(c1ccccn1)c1ccccn1.
What is the InChIKey of N-[methoxy(dipyridin-2-yl)methyl]benzamide?
The InChIKey is GSYSOFKJNCCQQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N3O2/c1-24-19(16-11-5-7-13-20-16,17-12-6-8-14-21-17)22-18(23)15-9-3-2-4-10-15/h2-14H,1H3,(H,22,23).
What are the key properties of N-[methoxy(dipyridin-2-yl)methyl]benzamide?
N-[methoxy(dipyridin-2-yl)methyl]benzamide has a molecular weight of 319.36 g/mol, XLogP of 2.75, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[methoxy(dipyridin-2-yl)methyl]benzamide is sourced from PubChem (CID 123194279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).