(6-methoxyfuro[2,3-b]quinolin-2-yl)-piperidin-1-ylmethanone

C18H18N2O3 — CID 3237525

IUPAC(6-methoxyfuro[2,3-b]quinolin-2-yl)-piperidin-1-ylmethanone
SMILESCOc1ccc2nc3oc(C(=O)N4CCCCC4)cc3cc2c1
InChIInChI=1S/C18H18N2O3/c1-22-14-5-6-15-12(10-14)9-13-11-16(23-17(13)19-15)18(21)20-7-3-2-4-8-20/h5-6,9-11H,2-4,7-8H2,1H3
InChIKeyNBVIJZCSUHGJCK-UHFFFAOYSA-N
MW310.35 g/mol
LogP3.62
Rot. Bonds2

About (6-methoxyfuro[2,3-b]quinolin-2-yl)-piperidin-1-ylmethanone

(6-methoxyfuro[2,3-b]quinolin-2-yl)-piperidin-1-ylmethanone (PubChem CID 3237525) has the molecular formula C18H18N2O3 and a molecular weight of 310.35 g/mol. Its IUPAC name is (6-methoxyfuro[2,3-b]quinolin-2-yl)-piperidin-1-ylmethanone.

Molecular Properties

Compound Name(6-methoxyfuro[2,3-b]quinolin-2-yl)-piperidin-1-ylmethanone
PubChem CID3237525
Molecular FormulaC18H18N2O3
Molecular Weight310.35 g/mol
Exact Mass310.13
IUPAC Name(6-methoxyfuro[2,3-b]quinolin-2-yl)-piperidin-1-ylmethanone
SMILESCOc1ccc2nc3oc(C(=O)N4CCCCC4)cc3cc2c1
InChIInChI=1S/C18H18N2O3/c1-22-14-5-6-15-12(10-14)9-13-11-16(23-17(13)19-15)18(21)20-7-3-2-4-8-20/h5-6,9-11H,2-4,7-8H2,1H3
InChIKeyNBVIJZCSUHGJCK-UHFFFAOYSA-N
XLogP3.62
TPSA55.57 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.35
LogP ≤ 53.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (6-methoxyfuro[2,3-b]quinolin-2-yl)-piperidin-1-ylmethanone?
The IUPAC name of (6-methoxyfuro[2,3-b]quinolin-2-yl)-piperidin-1-ylmethanone (CID 3237525) is (6-methoxyfuro[2,3-b]quinolin-2-yl)-piperidin-1-ylmethanone.
What is the SMILES notation for (6-methoxyfuro[2,3-b]quinolin-2-yl)-piperidin-1-ylmethanone?
The canonical SMILES for (6-methoxyfuro[2,3-b]quinolin-2-yl)-piperidin-1-ylmethanone is COc1ccc2nc3oc(C(=O)N4CCCCC4)cc3cc2c1.
What is the InChIKey of (6-methoxyfuro[2,3-b]quinolin-2-yl)-piperidin-1-ylmethanone?
The InChIKey is NBVIJZCSUHGJCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O3/c1-22-14-5-6-15-12(10-14)9-13-11-16(23-17(13)19-15)18(21)20-7-3-2-4-8-20/h5-6,9-11H,2-4,7-8H2,1H3.
What are the key properties of (6-methoxyfuro[2,3-b]quinolin-2-yl)-piperidin-1-ylmethanone?
(6-methoxyfuro[2,3-b]quinolin-2-yl)-piperidin-1-ylmethanone has a molecular weight of 310.35 g/mol, XLogP of 3.62, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (6-methoxyfuro[2,3-b]quinolin-2-yl)-piperidin-1-ylmethanone is sourced from PubChem (CID 3237525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).