7-methyl-N-(2-phenylethyl)furo[2,3-b]quinoline-2-carboxamide

C21H18N2O2 — CID 22582807

IUPAC7-methyl-N-(2-phenylethyl)furo[2,3-b]quinoline-2-carboxamide
SMILESCc1ccc2cc3cc(C(=O)NCCc4ccccc4)oc3nc2c1
InChIInChI=1S/C21H18N2O2/c1-14-7-8-16-12-17-13-19(25-21(17)23-18(16)11-14)20(24)22-10-9-15-5-3-2-4-6-15/h2-8,11-13H,9-10H2,1H3,(H,22,24)
InChIKeyZUTPFJVOCFDEGK-UHFFFAOYSA-N
MW330.39 g/mol
LogP4.26
Rot. Bonds4

About 7-methyl-N-(2-phenylethyl)furo[2,3-b]quinoline-2-carboxamide

7-methyl-N-(2-phenylethyl)furo[2,3-b]quinoline-2-carboxamide (PubChem CID 22582807) has the molecular formula C21H18N2O2 and a molecular weight of 330.39 g/mol. Its IUPAC name is 7-methyl-N-(2-phenylethyl)furo[2,3-b]quinoline-2-carboxamide.

Molecular Properties

Compound Name7-methyl-N-(2-phenylethyl)furo[2,3-b]quinoline-2-carboxamide
PubChem CID22582807
Molecular FormulaC21H18N2O2
Molecular Weight330.39 g/mol
Exact Mass330.14
IUPAC Name7-methyl-N-(2-phenylethyl)furo[2,3-b]quinoline-2-carboxamide
SMILESCc1ccc2cc3cc(C(=O)NCCc4ccccc4)oc3nc2c1
InChIInChI=1S/C21H18N2O2/c1-14-7-8-16-12-17-13-19(25-21(17)23-18(16)11-14)20(24)22-10-9-15-5-3-2-4-6-15/h2-8,11-13H,9-10H2,1H3,(H,22,24)
InChIKeyZUTPFJVOCFDEGK-UHFFFAOYSA-N
XLogP4.26
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.39
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7-methyl-N-(2-phenylethyl)furo[2,3-b]quinoline-2-carboxamide?
The IUPAC name of 7-methyl-N-(2-phenylethyl)furo[2,3-b]quinoline-2-carboxamide (CID 22582807) is 7-methyl-N-(2-phenylethyl)furo[2,3-b]quinoline-2-carboxamide.
What is the SMILES notation for 7-methyl-N-(2-phenylethyl)furo[2,3-b]quinoline-2-carboxamide?
The canonical SMILES for 7-methyl-N-(2-phenylethyl)furo[2,3-b]quinoline-2-carboxamide is Cc1ccc2cc3cc(C(=O)NCCc4ccccc4)oc3nc2c1.
What is the InChIKey of 7-methyl-N-(2-phenylethyl)furo[2,3-b]quinoline-2-carboxamide?
The InChIKey is ZUTPFJVOCFDEGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18N2O2/c1-14-7-8-16-12-17-13-19(25-21(17)23-18(16)11-14)20(24)22-10-9-15-5-3-2-4-6-15/h2-8,11-13H,9-10H2,1H3,(H,22,24).
What are the key properties of 7-methyl-N-(2-phenylethyl)furo[2,3-b]quinoline-2-carboxamide?
7-methyl-N-(2-phenylethyl)furo[2,3-b]quinoline-2-carboxamide has a molecular weight of 330.39 g/mol, XLogP of 4.26, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-N-(2-phenylethyl)furo[2,3-b]quinoline-2-carboxamide is sourced from PubChem (CID 22582807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).