6-(7-hydroxyquinolin-4-yl)oxy-N,2-dimethyl-1-benzofuran-3-carboxamide

C20H16N2O4 — CID 135507449

IUPAC6-(7-hydroxyquinolin-4-yl)oxy-N,2-dimethyl-1-benzofuran-3-carboxamide
SMILESCNC(=O)c1c(C)oc2cc(Oc3ccnc4cc(O)ccc34)ccc12
InChIInChI=1S/C20H16N2O4/c1-11-19(20(24)21-2)15-6-4-13(10-18(15)25-11)26-17-7-8-22-16-9-12(23)3-5-14(16)17/h3-10,23H,1-2H3,(H,21,24)
InChIKeySMQZOFDKBBJGHX-UHFFFAOYSA-N
MW348.36 g/mol
LogP4.15
Rot. Bonds3

About 6-(7-hydroxyquinolin-4-yl)oxy-N,2-dimethyl-1-benzofuran-3-carboxamide

6-(7-hydroxyquinolin-4-yl)oxy-N,2-dimethyl-1-benzofuran-3-carboxamide (PubChem CID 135507449) has the molecular formula C20H16N2O4 and a molecular weight of 348.36 g/mol. Its IUPAC name is 6-(7-hydroxyquinolin-4-yl)oxy-N,2-dimethyl-1-benzofuran-3-carboxamide.

Molecular Properties

Compound Name6-(7-hydroxyquinolin-4-yl)oxy-N,2-dimethyl-1-benzofuran-3-carboxamide
PubChem CID135507449
Molecular FormulaC20H16N2O4
Molecular Weight348.36 g/mol
Exact Mass348.11
IUPAC Name6-(7-hydroxyquinolin-4-yl)oxy-N,2-dimethyl-1-benzofuran-3-carboxamide
SMILESCNC(=O)c1c(C)oc2cc(Oc3ccnc4cc(O)ccc34)ccc12
InChIInChI=1S/C20H16N2O4/c1-11-19(20(24)21-2)15-6-4-13(10-18(15)25-11)26-17-7-8-22-16-9-12(23)3-5-14(16)17/h3-10,23H,1-2H3,(H,21,24)
InChIKeySMQZOFDKBBJGHX-UHFFFAOYSA-N
XLogP4.15
TPSA84.59 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.36
LogP ≤ 54.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[4-[[2-methyl-3-(methylcarbamoyl)-1-benzofuran-6-yl]oxy]quinolin-7-yl]oxyacetic acid
CID 11165656
6-(7-methoxyquinolin-4-yl)oxy-2-methyl-1-benzofuran-3-carboxamide
CID 143070677
N-(2-ethoxyethyl)-6-(7-methoxyquinolin-4-yl)oxy-2-methyl-1-benzofuran-3-carboxamide
CID 11418728
6-(6-hydroxyquinolin-4-yl)oxy-N,2-dimethyl-1-benzothiophene-3-carboxamide;methane
CID 158659942
6-(7-hydroxy-6-methoxyquinazolin-4-yl)oxy-N,2-dimethyl-1-benzofuran-3-carboxamide
CID 172990449
N-(4,6-dimethyl-2-pyridinyl)-2-methyl-6-(7-phenylmethoxyquinolin-4-yl)oxy-1-benzofuran-3-carboxamide
CID 59730751
N,5-dimethyl-4-[[2-methyl-3-(methylcarbamoyl)-1-benzofuran-6-yl]oxy]pyrrolo[1,2-b]pyridazine-6-carboxamide
CID 178115018
6-[2-[4-(hydroxymethyl)-1,3-thiazol-2-yl]thieno[3,2-b]pyridin-7-yl]oxy-N,2-dimethyl-1-benzofuran-3-carboxamide
CID 20767846
6-[7-[2-(7-hydroxy-5-azaspiro[2.4]heptan-5-yl)ethoxy]-6-methoxyquinolin-4-yl]oxy-N,2-dimethyl-1-benzofuran-3-carboxamide
CID 46175197
6-[6-(dihydroxymethyl)-5-methylpyrrolo[1,2-b]pyridazin-4-yl]oxy-N,2-dimethyl-1-benzofuran-3-carboxamide
CID 178115189
6-(3-cyano-6,7-dimethoxyquinolin-4-yl)oxy-N,2-dimethyl-1-benzofuran-3-carboxamide;ethane
CID 143892681
6-[7-[2-(5,8-dioxa-10-azadispiro[2.0.44.33]undecan-2-yl)ethoxy]-6-methoxyquinolin-4-yl]oxy-N,2-dimethyl-1-benzofuran-3-carboxamide
CID 66619047

Frequently Asked Questions

What is the IUPAC name of 6-(7-hydroxyquinolin-4-yl)oxy-N,2-dimethyl-1-benzofuran-3-carboxamide?
The IUPAC name of 6-(7-hydroxyquinolin-4-yl)oxy-N,2-dimethyl-1-benzofuran-3-carboxamide (CID 135507449) is 6-(7-hydroxyquinolin-4-yl)oxy-N,2-dimethyl-1-benzofuran-3-carboxamide.
What is the SMILES notation for 6-(7-hydroxyquinolin-4-yl)oxy-N,2-dimethyl-1-benzofuran-3-carboxamide?
The canonical SMILES for 6-(7-hydroxyquinolin-4-yl)oxy-N,2-dimethyl-1-benzofuran-3-carboxamide is CNC(=O)c1c(C)oc2cc(Oc3ccnc4cc(O)ccc34)ccc12.
What is the InChIKey of 6-(7-hydroxyquinolin-4-yl)oxy-N,2-dimethyl-1-benzofuran-3-carboxamide?
The InChIKey is SMQZOFDKBBJGHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N2O4/c1-11-19(20(24)21-2)15-6-4-13(10-18(15)25-11)26-17-7-8-22-16-9-12(23)3-5-14(16)17/h3-10,23H,1-2H3,(H,21,24).
What are the key properties of 6-(7-hydroxyquinolin-4-yl)oxy-N,2-dimethyl-1-benzofuran-3-carboxamide?
6-(7-hydroxyquinolin-4-yl)oxy-N,2-dimethyl-1-benzofuran-3-carboxamide has a molecular weight of 348.36 g/mol, XLogP of 4.15, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(7-hydroxyquinolin-4-yl)oxy-N,2-dimethyl-1-benzofuran-3-carboxamide is sourced from PubChem (CID 135507449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).