N-(2,5-dimethoxyphenyl)-7-methylfuro[2,3-b]quinoline-2-carboxamide

C21H18N2O4 — CID 15995839

IUPACN-(2,5-dimethoxyphenyl)-7-methylfuro[2,3-b]quinoline-2-carboxamide
SMILESCOc1ccc(OC)c(NC(=O)c2cc3cc4ccc(C)cc4nc3o2)c1
InChIInChI=1S/C21H18N2O4/c1-12-4-5-13-9-14-10-19(27-21(14)23-16(13)8-12)20(24)22-17-11-15(25-2)6-7-18(17)26-3/h4-11H,1-3H3,(H,22,24)
InChIKeyJXODGZNWBJERFM-UHFFFAOYSA-N
MW362.39 g/mol
LogP4.56
Rot. Bonds4

About N-(2,5-dimethoxyphenyl)-7-methylfuro[2,3-b]quinoline-2-carboxamide

N-(2,5-dimethoxyphenyl)-7-methylfuro[2,3-b]quinoline-2-carboxamide (PubChem CID 15995839) has the molecular formula C21H18N2O4 and a molecular weight of 362.39 g/mol. Its IUPAC name is N-(2,5-dimethoxyphenyl)-7-methylfuro[2,3-b]quinoline-2-carboxamide.

Molecular Properties

Compound NameN-(2,5-dimethoxyphenyl)-7-methylfuro[2,3-b]quinoline-2-carboxamide
PubChem CID15995839
Molecular FormulaC21H18N2O4
Molecular Weight362.39 g/mol
Exact Mass362.13
IUPAC NameN-(2,5-dimethoxyphenyl)-7-methylfuro[2,3-b]quinoline-2-carboxamide
SMILESCOc1ccc(OC)c(NC(=O)c2cc3cc4ccc(C)cc4nc3o2)c1
InChIInChI=1S/C21H18N2O4/c1-12-4-5-13-9-14-10-19(27-21(14)23-16(13)8-12)20(24)22-17-11-15(25-2)6-7-18(17)26-3/h4-11H,1-3H3,(H,22,24)
InChIKeyJXODGZNWBJERFM-UHFFFAOYSA-N
XLogP4.56
TPSA73.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.39
LogP ≤ 54.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethoxyphenyl)-7-methylfuro[2,3-b]quinoline-2-carboxamide?
The IUPAC name of N-(2,5-dimethoxyphenyl)-7-methylfuro[2,3-b]quinoline-2-carboxamide (CID 15995839) is N-(2,5-dimethoxyphenyl)-7-methylfuro[2,3-b]quinoline-2-carboxamide.
What is the SMILES notation for N-(2,5-dimethoxyphenyl)-7-methylfuro[2,3-b]quinoline-2-carboxamide?
The canonical SMILES for N-(2,5-dimethoxyphenyl)-7-methylfuro[2,3-b]quinoline-2-carboxamide is COc1ccc(OC)c(NC(=O)c2cc3cc4ccc(C)cc4nc3o2)c1.
What is the InChIKey of N-(2,5-dimethoxyphenyl)-7-methylfuro[2,3-b]quinoline-2-carboxamide?
The InChIKey is JXODGZNWBJERFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18N2O4/c1-12-4-5-13-9-14-10-19(27-21(14)23-16(13)8-12)20(24)22-17-11-15(25-2)6-7-18(17)26-3/h4-11H,1-3H3,(H,22,24).
What are the key properties of N-(2,5-dimethoxyphenyl)-7-methylfuro[2,3-b]quinoline-2-carboxamide?
N-(2,5-dimethoxyphenyl)-7-methylfuro[2,3-b]quinoline-2-carboxamide has a molecular weight of 362.39 g/mol, XLogP of 4.56, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethoxyphenyl)-7-methylfuro[2,3-b]quinoline-2-carboxamide is sourced from PubChem (CID 15995839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).