7-(2-methoxyethyl)-2-quinolin-2-yl-2,7-diazaspiro[4.5]decan-6-one

C20H25N3O2 — CID 70732766

IUPAC7-(2-methoxyethyl)-2-quinolin-2-yl-2,7-diazaspiro[4.5]decan-6-one
SMILESCOCCN1CCCC2(CCN(c3ccc4ccccc4n3)C2)C1=O
InChIInChI=1S/C20H25N3O2/c1-25-14-13-22-11-4-9-20(19(22)24)10-12-23(15-20)18-8-7-16-5-2-3-6-17(16)21-18/h2-3,5-8H,4,9-15H2,1H3
InChIKeyQPVJFTDVWVAZME-UHFFFAOYSA-N
MW339.44 g/mol
LogP2.70
Rot. Bonds4

About 7-(2-methoxyethyl)-2-quinolin-2-yl-2,7-diazaspiro[4.5]decan-6-one

7-(2-methoxyethyl)-2-quinolin-2-yl-2,7-diazaspiro[4.5]decan-6-one (PubChem CID 70732766) has the molecular formula C20H25N3O2 and a molecular weight of 339.44 g/mol. Its IUPAC name is 7-(2-methoxyethyl)-2-quinolin-2-yl-2,7-diazaspiro[4.5]decan-6-one.

Molecular Properties

Compound Name7-(2-methoxyethyl)-2-quinolin-2-yl-2,7-diazaspiro[4.5]decan-6-one
PubChem CID70732766
Molecular FormulaC20H25N3O2
Molecular Weight339.44 g/mol
Exact Mass339.19
IUPAC Name7-(2-methoxyethyl)-2-quinolin-2-yl-2,7-diazaspiro[4.5]decan-6-one
SMILESCOCCN1CCCC2(CCN(c3ccc4ccccc4n3)C2)C1=O
InChIInChI=1S/C20H25N3O2/c1-25-14-13-22-11-4-9-20(19(22)24)10-12-23(15-20)18-8-7-16-5-2-3-6-17(16)21-18/h2-3,5-8H,4,9-15H2,1H3
InChIKeyQPVJFTDVWVAZME-UHFFFAOYSA-N
XLogP2.70
TPSA45.67 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.44
LogP ≤ 52.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7-(2-methoxyethyl)-2-quinolin-2-yl-2,7-diazaspiro[4.5]decan-6-one?
The IUPAC name of 7-(2-methoxyethyl)-2-quinolin-2-yl-2,7-diazaspiro[4.5]decan-6-one (CID 70732766) is 7-(2-methoxyethyl)-2-quinolin-2-yl-2,7-diazaspiro[4.5]decan-6-one.
What is the SMILES notation for 7-(2-methoxyethyl)-2-quinolin-2-yl-2,7-diazaspiro[4.5]decan-6-one?
The canonical SMILES for 7-(2-methoxyethyl)-2-quinolin-2-yl-2,7-diazaspiro[4.5]decan-6-one is COCCN1CCCC2(CCN(c3ccc4ccccc4n3)C2)C1=O.
What is the InChIKey of 7-(2-methoxyethyl)-2-quinolin-2-yl-2,7-diazaspiro[4.5]decan-6-one?
The InChIKey is QPVJFTDVWVAZME-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O2/c1-25-14-13-22-11-4-9-20(19(22)24)10-12-23(15-20)18-8-7-16-5-2-3-6-17(16)21-18/h2-3,5-8H,4,9-15H2,1H3.
What are the key properties of 7-(2-methoxyethyl)-2-quinolin-2-yl-2,7-diazaspiro[4.5]decan-6-one?
7-(2-methoxyethyl)-2-quinolin-2-yl-2,7-diazaspiro[4.5]decan-6-one has a molecular weight of 339.44 g/mol, XLogP of 2.70, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(2-methoxyethyl)-2-quinolin-2-yl-2,7-diazaspiro[4.5]decan-6-one is sourced from PubChem (CID 70732766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).