5-(phenoxymethyl)-N-quinolin-3-ylfuran-2-carboxamide

C21H16N2O3 — CID 31031057

IUPAC5-(phenoxymethyl)-N-quinolin-3-ylfuran-2-carboxamide
SMILESO=C(Nc1cnc2ccccc2c1)c1ccc(COc2ccccc2)o1
InChIInChI=1S/C21H16N2O3/c24-21(23-16-12-15-6-4-5-9-19(15)22-13-16)20-11-10-18(26-20)14-25-17-7-2-1-3-8-17/h1-13H,14H2,(H,23,24)
InChIKeyZPOLICSBTRKKQM-UHFFFAOYSA-N
MW344.37 g/mol
LogP4.66
Rot. Bonds5

About 5-(phenoxymethyl)-N-quinolin-3-ylfuran-2-carboxamide

5-(phenoxymethyl)-N-quinolin-3-ylfuran-2-carboxamide (PubChem CID 31031057) has the molecular formula C21H16N2O3 and a molecular weight of 344.37 g/mol. Its IUPAC name is 5-(phenoxymethyl)-N-quinolin-3-ylfuran-2-carboxamide.

Molecular Properties

Compound Name5-(phenoxymethyl)-N-quinolin-3-ylfuran-2-carboxamide
PubChem CID31031057
Molecular FormulaC21H16N2O3
Molecular Weight344.37 g/mol
Exact Mass344.12
IUPAC Name5-(phenoxymethyl)-N-quinolin-3-ylfuran-2-carboxamide
SMILESO=C(Nc1cnc2ccccc2c1)c1ccc(COc2ccccc2)o1
InChIInChI=1S/C21H16N2O3/c24-21(23-16-12-15-6-4-5-9-19(15)22-13-16)20-11-10-18(26-20)14-25-17-7-2-1-3-8-17/h1-13H,14H2,(H,23,24)
InChIKeyZPOLICSBTRKKQM-UHFFFAOYSA-N
XLogP4.66
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.37
LogP ≤ 54.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(7-methoxyquinolin-3-yl)-5-[(2-methylphenoxy)methyl]furan-2-carboxamide
CID 95744848
5-[(2-bromophenoxy)methyl]-N-(7-methoxyquinolin-3-yl)furan-2-carboxamide
CID 95744847
5-(naphthalen-2-yloxymethyl)-N-pyridin-3-ylfuran-2-carboxamide
CID 717197
N-(3-methylphenyl)-5-(phenoxymethyl)furan-2-carboxamide
CID 7464174
5-[(4-methylphenoxy)methyl]-N-phenylfuran-2-carboxamide
CID 7454734
N'-[5-(phenoxymethyl)furan-2-carbonyl]quinoline-2-carbohydrazide
CID 9219810
5-(phenoxymethyl)-N-(6-pyrrolidin-1-yl-3-pyridinyl)furan-2-carboxamide
CID 43041629
N-(3-cyanophenyl)-5-(phenoxymethyl)furan-2-carboxamide
CID 9245570
5-[(4-fluorophenoxy)methyl]-N-(4-phenylphenyl)furan-2-carboxamide
CID 19413095
4-(methoxymethyl)-N-quinolin-3-ylbenzamide
CID 18153378
5-[(3,4-dimethylphenoxy)methyl]-N-phenylfuran-2-carboxamide
CID 19450839
N-methyl-5-(phenoxymethyl)furan-2-carboxamide
CID 7678218

Frequently Asked Questions

What is the IUPAC name of 5-(phenoxymethyl)-N-quinolin-3-ylfuran-2-carboxamide?
The IUPAC name of 5-(phenoxymethyl)-N-quinolin-3-ylfuran-2-carboxamide (CID 31031057) is 5-(phenoxymethyl)-N-quinolin-3-ylfuran-2-carboxamide.
What is the SMILES notation for 5-(phenoxymethyl)-N-quinolin-3-ylfuran-2-carboxamide?
The canonical SMILES for 5-(phenoxymethyl)-N-quinolin-3-ylfuran-2-carboxamide is O=C(Nc1cnc2ccccc2c1)c1ccc(COc2ccccc2)o1.
What is the InChIKey of 5-(phenoxymethyl)-N-quinolin-3-ylfuran-2-carboxamide?
The InChIKey is ZPOLICSBTRKKQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16N2O3/c24-21(23-16-12-15-6-4-5-9-19(15)22-13-16)20-11-10-18(26-20)14-25-17-7-2-1-3-8-17/h1-13H,14H2,(H,23,24).
What are the key properties of 5-(phenoxymethyl)-N-quinolin-3-ylfuran-2-carboxamide?
5-(phenoxymethyl)-N-quinolin-3-ylfuran-2-carboxamide has a molecular weight of 344.37 g/mol, XLogP of 4.66, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(phenoxymethyl)-N-quinolin-3-ylfuran-2-carboxamide is sourced from PubChem (CID 31031057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).