6-methoxy-N-(3-methoxypropyl)furo[2,3-b]quinoline-2-carboxamide

C17H18N2O4 — CID 20853842

IUPAC6-methoxy-N-(3-methoxypropyl)furo[2,3-b]quinoline-2-carboxamide
SMILESCOCCCNC(=O)c1cc2cc3cc(OC)ccc3nc2o1
InChIInChI=1S/C17H18N2O4/c1-21-7-3-6-18-16(20)15-10-12-8-11-9-13(22-2)4-5-14(11)19-17(12)23-15/h4-5,8-10H,3,6-7H2,1-2H3,(H,18,20)
InChIKeyOXURTYPCTLSMGK-UHFFFAOYSA-N
MW314.34 g/mol
LogP2.76
Rot. Bonds6

About 6-methoxy-N-(3-methoxypropyl)furo[2,3-b]quinoline-2-carboxamide

6-methoxy-N-(3-methoxypropyl)furo[2,3-b]quinoline-2-carboxamide (PubChem CID 20853842) has the molecular formula C17H18N2O4 and a molecular weight of 314.34 g/mol. Its IUPAC name is 6-methoxy-N-(3-methoxypropyl)furo[2,3-b]quinoline-2-carboxamide.

Molecular Properties

Compound Name6-methoxy-N-(3-methoxypropyl)furo[2,3-b]quinoline-2-carboxamide
PubChem CID20853842
Molecular FormulaC17H18N2O4
Molecular Weight314.34 g/mol
Exact Mass314.13
IUPAC Name6-methoxy-N-(3-methoxypropyl)furo[2,3-b]quinoline-2-carboxamide
SMILESCOCCCNC(=O)c1cc2cc3cc(OC)ccc3nc2o1
InChIInChI=1S/C17H18N2O4/c1-21-7-3-6-18-16(20)15-10-12-8-11-9-13(22-2)4-5-14(11)19-17(12)23-15/h4-5,8-10H,3,6-7H2,1-2H3,(H,18,20)
InChIKeyOXURTYPCTLSMGK-UHFFFAOYSA-N
XLogP2.76
TPSA73.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.34
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-methoxy-N-(3-methoxypropyl)furo[2,3-b]quinoline-2-carboxamide?
The IUPAC name of 6-methoxy-N-(3-methoxypropyl)furo[2,3-b]quinoline-2-carboxamide (CID 20853842) is 6-methoxy-N-(3-methoxypropyl)furo[2,3-b]quinoline-2-carboxamide.
What is the SMILES notation for 6-methoxy-N-(3-methoxypropyl)furo[2,3-b]quinoline-2-carboxamide?
The canonical SMILES for 6-methoxy-N-(3-methoxypropyl)furo[2,3-b]quinoline-2-carboxamide is COCCCNC(=O)c1cc2cc3cc(OC)ccc3nc2o1.
What is the InChIKey of 6-methoxy-N-(3-methoxypropyl)furo[2,3-b]quinoline-2-carboxamide?
The InChIKey is OXURTYPCTLSMGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O4/c1-21-7-3-6-18-16(20)15-10-12-8-11-9-13(22-2)4-5-14(11)19-17(12)23-15/h4-5,8-10H,3,6-7H2,1-2H3,(H,18,20).
What are the key properties of 6-methoxy-N-(3-methoxypropyl)furo[2,3-b]quinoline-2-carboxamide?
6-methoxy-N-(3-methoxypropyl)furo[2,3-b]quinoline-2-carboxamide has a molecular weight of 314.34 g/mol, XLogP of 2.76, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-N-(3-methoxypropyl)furo[2,3-b]quinoline-2-carboxamide is sourced from PubChem (CID 20853842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).