2-hydroxy-4-methoxy-N-(8-methylquinolin-5-yl)benzamide

C18H16N2O3 — CID 112812578

IUPAC2-hydroxy-4-methoxy-N-(8-methylquinolin-5-yl)benzamide
SMILESCOc1ccc(C(=O)Nc2ccc(C)c3ncccc23)c(O)c1
InChIInChI=1S/C18H16N2O3/c1-11-5-8-15(13-4-3-9-19-17(11)13)20-18(22)14-7-6-12(23-2)10-16(14)21/h3-10,21H,1-2H3,(H,20,22)
InChIKeyIOUNXWQVTBDJOX-UHFFFAOYSA-N
MW308.34 g/mol
LogP3.51
Rot. Bonds3

About 2-hydroxy-4-methoxy-N-(8-methylquinolin-5-yl)benzamide

2-hydroxy-4-methoxy-N-(8-methylquinolin-5-yl)benzamide (PubChem CID 112812578) has the molecular formula C18H16N2O3 and a molecular weight of 308.34 g/mol. Its IUPAC name is 2-hydroxy-4-methoxy-N-(8-methylquinolin-5-yl)benzamide.

Molecular Properties

Compound Name2-hydroxy-4-methoxy-N-(8-methylquinolin-5-yl)benzamide
PubChem CID112812578
Molecular FormulaC18H16N2O3
Molecular Weight308.34 g/mol
Exact Mass308.12
IUPAC Name2-hydroxy-4-methoxy-N-(8-methylquinolin-5-yl)benzamide
SMILESCOc1ccc(C(=O)Nc2ccc(C)c3ncccc23)c(O)c1
InChIInChI=1S/C18H16N2O3/c1-11-5-8-15(13-4-3-9-19-17(11)13)20-18(22)14-7-6-12(23-2)10-16(14)21/h3-10,21H,1-2H3,(H,20,22)
InChIKeyIOUNXWQVTBDJOX-UHFFFAOYSA-N
XLogP3.51
TPSA71.45 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.34
LogP ≤ 53.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-4-methoxy-N-(8-methylquinolin-5-yl)benzamide?
The IUPAC name of 2-hydroxy-4-methoxy-N-(8-methylquinolin-5-yl)benzamide (CID 112812578) is 2-hydroxy-4-methoxy-N-(8-methylquinolin-5-yl)benzamide.
What is the SMILES notation for 2-hydroxy-4-methoxy-N-(8-methylquinolin-5-yl)benzamide?
The canonical SMILES for 2-hydroxy-4-methoxy-N-(8-methylquinolin-5-yl)benzamide is COc1ccc(C(=O)Nc2ccc(C)c3ncccc23)c(O)c1.
What is the InChIKey of 2-hydroxy-4-methoxy-N-(8-methylquinolin-5-yl)benzamide?
The InChIKey is IOUNXWQVTBDJOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O3/c1-11-5-8-15(13-4-3-9-19-17(11)13)20-18(22)14-7-6-12(23-2)10-16(14)21/h3-10,21H,1-2H3,(H,20,22).
What are the key properties of 2-hydroxy-4-methoxy-N-(8-methylquinolin-5-yl)benzamide?
2-hydroxy-4-methoxy-N-(8-methylquinolin-5-yl)benzamide has a molecular weight of 308.34 g/mol, XLogP of 3.51, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-4-methoxy-N-(8-methylquinolin-5-yl)benzamide is sourced from PubChem (CID 112812578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).