N-(7-methoxyquinolin-3-yl)-3-methyl-1-benzofuran-2-carboxamide

C20H16N2O3 — CID 54773926

IUPACN-(7-methoxyquinolin-3-yl)-3-methyl-1-benzofuran-2-carboxamide
SMILESCOc1ccc2cc(NC(=O)c3oc4ccccc4c3C)cnc2c1
InChIInChI=1S/C20H16N2O3/c1-12-16-5-3-4-6-18(16)25-19(12)20(23)22-14-9-13-7-8-15(24-2)10-17(13)21-11-14/h3-11H,1-2H3,(H,22,23)
InChIKeyOUPQWXQYEISKES-UHFFFAOYSA-N
MW332.36 g/mol
LogP4.55
Rot. Bonds3

About N-(7-methoxyquinolin-3-yl)-3-methyl-1-benzofuran-2-carboxamide

N-(7-methoxyquinolin-3-yl)-3-methyl-1-benzofuran-2-carboxamide (PubChem CID 54773926) has the molecular formula C20H16N2O3 and a molecular weight of 332.36 g/mol. Its IUPAC name is N-(7-methoxyquinolin-3-yl)-3-methyl-1-benzofuran-2-carboxamide.

Molecular Properties

Compound NameN-(7-methoxyquinolin-3-yl)-3-methyl-1-benzofuran-2-carboxamide
PubChem CID54773926
Molecular FormulaC20H16N2O3
Molecular Weight332.36 g/mol
Exact Mass332.12
IUPAC NameN-(7-methoxyquinolin-3-yl)-3-methyl-1-benzofuran-2-carboxamide
SMILESCOc1ccc2cc(NC(=O)c3oc4ccccc4c3C)cnc2c1
InChIInChI=1S/C20H16N2O3/c1-12-16-5-3-4-6-18(16)25-19(12)20(23)22-14-9-13-7-8-15(24-2)10-17(13)21-11-14/h3-11H,1-2H3,(H,22,23)
InChIKeyOUPQWXQYEISKES-UHFFFAOYSA-N
XLogP4.55
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.36
LogP ≤ 54.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(7-methoxyquinolin-3-yl)-3,5-dimethyl-1-benzofuran-2-carboxamide
CID 95744990
N-(3,5-dimethoxyphenyl)-5-methoxy-3-methyl-1-benzofuran-2-carboxamide
CID 7959819
N-(7-methoxyquinolin-3-yl)-4-phenylbenzamide
CID 95745146
N-(7-methoxyquinolin-3-yl)-5-[(2-methylphenoxy)methyl]furan-2-carboxamide
CID 95744848
2-benzoyl-N-(7-methoxyquinolin-3-yl)benzamide
CID 54773922
N-(7-methoxyquinolin-3-yl)-4-phenylmethoxybenzamide
CID 95745112
3-methyl-N-pyridin-4-yl-1-benzofuran-2-carboxamide
CID 648777
N-[(Z)-(6-methoxynaphthalen-2-yl)methylideneamino]-3-methyl-1-benzofuran-2-carboxamide
CID 9464323
N-[4-(4-ethoxyphenoxy)phenyl]-3-methyl-1-benzofuran-2-carboxamide
CID 7925267
N-(7-methoxyquinolin-3-yl)-1-methylpyrazole-3-carboxamide
CID 95744911
N-(7-methoxyquinolin-3-yl)-2-(4-methyl-2-oxochromen-7-yl)oxyacetamide
CID 71826068
5-[(2-bromophenoxy)methyl]-N-(7-methoxyquinolin-3-yl)furan-2-carboxamide
CID 95744847

Frequently Asked Questions

What is the IUPAC name of N-(7-methoxyquinolin-3-yl)-3-methyl-1-benzofuran-2-carboxamide?
The IUPAC name of N-(7-methoxyquinolin-3-yl)-3-methyl-1-benzofuran-2-carboxamide (CID 54773926) is N-(7-methoxyquinolin-3-yl)-3-methyl-1-benzofuran-2-carboxamide.
What is the SMILES notation for N-(7-methoxyquinolin-3-yl)-3-methyl-1-benzofuran-2-carboxamide?
The canonical SMILES for N-(7-methoxyquinolin-3-yl)-3-methyl-1-benzofuran-2-carboxamide is COc1ccc2cc(NC(=O)c3oc4ccccc4c3C)cnc2c1.
What is the InChIKey of N-(7-methoxyquinolin-3-yl)-3-methyl-1-benzofuran-2-carboxamide?
The InChIKey is OUPQWXQYEISKES-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N2O3/c1-12-16-5-3-4-6-18(16)25-19(12)20(23)22-14-9-13-7-8-15(24-2)10-17(13)21-11-14/h3-11H,1-2H3,(H,22,23).
What are the key properties of N-(7-methoxyquinolin-3-yl)-3-methyl-1-benzofuran-2-carboxamide?
N-(7-methoxyquinolin-3-yl)-3-methyl-1-benzofuran-2-carboxamide has a molecular weight of 332.36 g/mol, XLogP of 4.55, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(7-methoxyquinolin-3-yl)-3-methyl-1-benzofuran-2-carboxamide is sourced from PubChem (CID 54773926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).