N-(1-ethyl-7-methylpyrazolo[5,4-b]quinolin-3-yl)furan-2-carboxamide

C18H16N4O2 — CID 664852

IUPACN-(1-ethyl-7-methylpyrazolo[5,4-b]quinolin-3-yl)furan-2-carboxamide
SMILESCCn1nc(NC(=O)c2ccco2)c2cc3ccc(C)cc3nc21
InChIInChI=1S/C18H16N4O2/c1-3-22-17-13(10-12-7-6-11(2)9-14(12)19-17)16(21-22)20-18(23)15-5-4-8-24-15/h4-10H,3H2,1-2H3,(H,20,21,23)
InChIKeyOPWCPOLKIVKSBG-UHFFFAOYSA-N
MW320.35 g/mol
LogP3.76
Rot. Bonds3

About N-(1-ethyl-7-methylpyrazolo[5,4-b]quinolin-3-yl)furan-2-carboxamide

N-(1-ethyl-7-methylpyrazolo[5,4-b]quinolin-3-yl)furan-2-carboxamide (PubChem CID 664852) has the molecular formula C18H16N4O2 and a molecular weight of 320.35 g/mol. Its IUPAC name is N-(1-ethyl-7-methylpyrazolo[5,4-b]quinolin-3-yl)furan-2-carboxamide.

Molecular Properties

Compound NameN-(1-ethyl-7-methylpyrazolo[5,4-b]quinolin-3-yl)furan-2-carboxamide
PubChem CID664852
Molecular FormulaC18H16N4O2
Molecular Weight320.35 g/mol
Exact Mass320.13
IUPAC NameN-(1-ethyl-7-methylpyrazolo[5,4-b]quinolin-3-yl)furan-2-carboxamide
SMILESCCn1nc(NC(=O)c2ccco2)c2cc3ccc(C)cc3nc21
InChIInChI=1S/C18H16N4O2/c1-3-22-17-13(10-12-7-6-11(2)9-14(12)19-17)16(21-22)20-18(23)15-5-4-8-24-15/h4-10H,3H2,1-2H3,(H,20,21,23)
InChIKeyOPWCPOLKIVKSBG-UHFFFAOYSA-N
XLogP3.76
TPSA72.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.35
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(1-ethyl-7-methylpyrazolo[5,4-b]quinolin-3-yl)furan-2-carboxamide?
The IUPAC name of N-(1-ethyl-7-methylpyrazolo[5,4-b]quinolin-3-yl)furan-2-carboxamide (CID 664852) is N-(1-ethyl-7-methylpyrazolo[5,4-b]quinolin-3-yl)furan-2-carboxamide.
What is the SMILES notation for N-(1-ethyl-7-methylpyrazolo[5,4-b]quinolin-3-yl)furan-2-carboxamide?
The canonical SMILES for N-(1-ethyl-7-methylpyrazolo[5,4-b]quinolin-3-yl)furan-2-carboxamide is CCn1nc(NC(=O)c2ccco2)c2cc3ccc(C)cc3nc21.
What is the InChIKey of N-(1-ethyl-7-methylpyrazolo[5,4-b]quinolin-3-yl)furan-2-carboxamide?
The InChIKey is OPWCPOLKIVKSBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N4O2/c1-3-22-17-13(10-12-7-6-11(2)9-14(12)19-17)16(21-22)20-18(23)15-5-4-8-24-15/h4-10H,3H2,1-2H3,(H,20,21,23).
What are the key properties of N-(1-ethyl-7-methylpyrazolo[5,4-b]quinolin-3-yl)furan-2-carboxamide?
N-(1-ethyl-7-methylpyrazolo[5,4-b]quinolin-3-yl)furan-2-carboxamide has a molecular weight of 320.35 g/mol, XLogP of 3.76, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethyl-7-methylpyrazolo[5,4-b]quinolin-3-yl)furan-2-carboxamide is sourced from PubChem (CID 664852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).