N-(8-hydroxyquinolin-7-yl)-N-(3-methoxyphenyl)formamide

C17H14N2O3 — CID 141211393

IUPACN-(8-hydroxyquinolin-7-yl)-N-(3-methoxyphenyl)formamide
SMILESCOc1cccc(N(C=O)c2ccc3cccnc3c2O)c1
InChIInChI=1S/C17H14N2O3/c1-22-14-6-2-5-13(10-14)19(11-20)15-8-7-12-4-3-9-18-16(12)17(15)21/h2-11,21H,1H3
InChIKeyZQNNYYYAZJDQQS-UHFFFAOYSA-N
MW294.31 g/mol
LogP3.24
Rot. Bonds4

About N-(8-hydroxyquinolin-7-yl)-N-(3-methoxyphenyl)formamide

N-(8-hydroxyquinolin-7-yl)-N-(3-methoxyphenyl)formamide (PubChem CID 141211393) has the molecular formula C17H14N2O3 and a molecular weight of 294.31 g/mol. Its IUPAC name is N-(8-hydroxyquinolin-7-yl)-N-(3-methoxyphenyl)formamide.

Molecular Properties

Compound NameN-(8-hydroxyquinolin-7-yl)-N-(3-methoxyphenyl)formamide
PubChem CID141211393
Molecular FormulaC17H14N2O3
Molecular Weight294.31 g/mol
Exact Mass294.10
IUPAC NameN-(8-hydroxyquinolin-7-yl)-N-(3-methoxyphenyl)formamide
SMILESCOc1cccc(N(C=O)c2ccc3cccnc3c2O)c1
InChIInChI=1S/C17H14N2O3/c1-22-14-6-2-5-13(10-14)19(11-20)15-8-7-12-4-3-9-18-16(12)17(15)21/h2-11,21H,1H3
InChIKeyZQNNYYYAZJDQQS-UHFFFAOYSA-N
XLogP3.24
TPSA62.66 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.31
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(8-hydroxyquinolin-7-yl)-N-(3-methoxyphenyl)formamide?
The IUPAC name of N-(8-hydroxyquinolin-7-yl)-N-(3-methoxyphenyl)formamide (CID 141211393) is N-(8-hydroxyquinolin-7-yl)-N-(3-methoxyphenyl)formamide.
What is the SMILES notation for N-(8-hydroxyquinolin-7-yl)-N-(3-methoxyphenyl)formamide?
The canonical SMILES for N-(8-hydroxyquinolin-7-yl)-N-(3-methoxyphenyl)formamide is COc1cccc(N(C=O)c2ccc3cccnc3c2O)c1.
What is the InChIKey of N-(8-hydroxyquinolin-7-yl)-N-(3-methoxyphenyl)formamide?
The InChIKey is ZQNNYYYAZJDQQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N2O3/c1-22-14-6-2-5-13(10-14)19(11-20)15-8-7-12-4-3-9-18-16(12)17(15)21/h2-11,21H,1H3.
What are the key properties of N-(8-hydroxyquinolin-7-yl)-N-(3-methoxyphenyl)formamide?
N-(8-hydroxyquinolin-7-yl)-N-(3-methoxyphenyl)formamide has a molecular weight of 294.31 g/mol, XLogP of 3.24, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(8-hydroxyquinolin-7-yl)-N-(3-methoxyphenyl)formamide is sourced from PubChem (CID 141211393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).