2,4-dimethoxy-N-(3-phenyl-1,8-naphthyridin-2-yl)benzamide

C23H19N3O3 — CID 42111217

IUPAC2,4-dimethoxy-N-(3-phenyl-1,8-naphthyridin-2-yl)benzamide
SMILESCOc1ccc(C(=O)Nc2nc3ncccc3cc2-c2ccccc2)c(OC)c1
InChIInChI=1S/C23H19N3O3/c1-28-17-10-11-18(20(14-17)29-2)23(27)26-22-19(15-7-4-3-5-8-15)13-16-9-6-12-24-21(16)25-22/h3-14H,1-2H3,(H,24,25,26,27)
InChIKeyNIOSCQHCAQECGQ-UHFFFAOYSA-N
MW385.42 g/mol
LogP4.57
Rot. Bonds5

About 2,4-dimethoxy-N-(3-phenyl-1,8-naphthyridin-2-yl)benzamide

2,4-dimethoxy-N-(3-phenyl-1,8-naphthyridin-2-yl)benzamide (PubChem CID 42111217) has the molecular formula C23H19N3O3 and a molecular weight of 385.42 g/mol. Its IUPAC name is 2,4-dimethoxy-N-(3-phenyl-1,8-naphthyridin-2-yl)benzamide.

Molecular Properties

Compound Name2,4-dimethoxy-N-(3-phenyl-1,8-naphthyridin-2-yl)benzamide
PubChem CID42111217
Molecular FormulaC23H19N3O3
Molecular Weight385.42 g/mol
Exact Mass385.14
IUPAC Name2,4-dimethoxy-N-(3-phenyl-1,8-naphthyridin-2-yl)benzamide
SMILESCOc1ccc(C(=O)Nc2nc3ncccc3cc2-c2ccccc2)c(OC)c1
InChIInChI=1S/C23H19N3O3/c1-28-17-10-11-18(20(14-17)29-2)23(27)26-22-19(15-7-4-3-5-8-15)13-16-9-6-12-24-21(16)25-22/h3-14H,1-2H3,(H,24,25,26,27)
InChIKeyNIOSCQHCAQECGQ-UHFFFAOYSA-N
XLogP4.57
TPSA73.34 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms29
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.42
LogP ≤ 54.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2,4-dimethoxy-N-(3-phenyl-1,8-naphthyridin-2-yl)benzamide?
The IUPAC name of 2,4-dimethoxy-N-(3-phenyl-1,8-naphthyridin-2-yl)benzamide (CID 42111217) is 2,4-dimethoxy-N-(3-phenyl-1,8-naphthyridin-2-yl)benzamide.
What is the SMILES notation for 2,4-dimethoxy-N-(3-phenyl-1,8-naphthyridin-2-yl)benzamide?
The canonical SMILES for 2,4-dimethoxy-N-(3-phenyl-1,8-naphthyridin-2-yl)benzamide is COc1ccc(C(=O)Nc2nc3ncccc3cc2-c2ccccc2)c(OC)c1.
What is the InChIKey of 2,4-dimethoxy-N-(3-phenyl-1,8-naphthyridin-2-yl)benzamide?
The InChIKey is NIOSCQHCAQECGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19N3O3/c1-28-17-10-11-18(20(14-17)29-2)23(27)26-22-19(15-7-4-3-5-8-15)13-16-9-6-12-24-21(16)25-22/h3-14H,1-2H3,(H,24,25,26,27).
What are the key properties of 2,4-dimethoxy-N-(3-phenyl-1,8-naphthyridin-2-yl)benzamide?
2,4-dimethoxy-N-(3-phenyl-1,8-naphthyridin-2-yl)benzamide has a molecular weight of 385.42 g/mol, XLogP of 4.57, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethoxy-N-(3-phenyl-1,8-naphthyridin-2-yl)benzamide is sourced from PubChem (CID 42111217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).