8-[[(4R,5R)-4-methoxy-7-azaspiro[4.5]decan-7-yl]methyl]quinoline

C20H26N2O — CID 165423233

IUPAC8-[[(4R,5R)-4-methoxy-7-azaspiro[4.5]decan-7-yl]methyl]quinoline
SMILESCO[C@@H]1CCC[C@]12CCCN(Cc1cccc3cccnc13)C2
InChIInChI=1S/C20H26N2O/c1-23-18-9-3-10-20(18)11-5-13-22(15-20)14-17-7-2-6-16-8-4-12-21-19(16)17/h2,4,6-8,12,18H,3,5,9-11,13-15H2,1H3/t18-,20-/m1/s1
InChIKeyVJXPFKXFVFMGDM-UYAOXDASSA-N
MW310.44 g/mol
LogP4.02
Rot. Bonds3

About 8-[[(4R,5R)-4-methoxy-7-azaspiro[4.5]decan-7-yl]methyl]quinoline

8-[[(4R,5R)-4-methoxy-7-azaspiro[4.5]decan-7-yl]methyl]quinoline (PubChem CID 165423233) has the molecular formula C20H26N2O and a molecular weight of 310.44 g/mol. Its IUPAC name is 8-[[(4R,5R)-4-methoxy-7-azaspiro[4.5]decan-7-yl]methyl]quinoline.

Molecular Properties

Compound Name8-[[(4R,5R)-4-methoxy-7-azaspiro[4.5]decan-7-yl]methyl]quinoline
PubChem CID165423233
Molecular FormulaC20H26N2O
Molecular Weight310.44 g/mol
Exact Mass310.20
IUPAC Name8-[[(4R,5R)-4-methoxy-7-azaspiro[4.5]decan-7-yl]methyl]quinoline
SMILESCO[C@@H]1CCC[C@]12CCCN(Cc1cccc3cccnc13)C2
InChIInChI=1S/C20H26N2O/c1-23-18-9-3-10-20(18)11-5-13-22(15-20)14-17-7-2-6-16-8-4-12-21-19(16)17/h2,4,6-8,12,18H,3,5,9-11,13-15H2,1H3/t18-,20-/m1/s1
InChIKeyVJXPFKXFVFMGDM-UYAOXDASSA-N
XLogP4.02
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.44
LogP ≤ 54.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 8-[[(4R,5R)-4-methoxy-7-azaspiro[4.5]decan-7-yl]methyl]quinoline with MolForge

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Related Compounds

3-[[(4R,5S)-4-methoxy-7-azaspiro[4.5]decan-7-yl]methyl]-1-methylpyridin-2-one
CID 165421706
(4R,5R)-4-methoxy-7-[(4-pyridin-2-ylphenyl)methyl]-7-azaspiro[4.5]decane
CID 165427222
(4R,5R)-7-[(2-chloro-5-fluorophenyl)methyl]-4-methoxy-7-azaspiro[4.5]decane
CID 135091609
(4R,5R)-7-[(3,4-dimethylphenyl)methyl]-4-methoxy-7-azaspiro[4.5]decane
CID 135089438
8-[(3-ethyl-3-methyl-1,4-diazepan-1-yl)methyl]quinoline
CID 64871920
(4R,5R)-7-[(5-ethylthiophen-2-yl)methyl]-4-methoxy-7-azaspiro[4.5]decane
CID 135105548
(4R,5R)-4-methoxy-7-[[4-(3-methylphenyl)phenyl]methyl]-7-azaspiro[4.5]decane
CID 166619064
8-[(3,3-dimethylpiperazin-1-yl)methyl]quinoline
CID 64832242
2-(quinolin-8-ylmethyl)-2,8-diazaspiro[4.5]decane
CID 120907566
2-[4-[[(4R,5S)-4-methoxy-7-azaspiro[4.5]decan-7-yl]methyl]phenoxy]ethanol
CID 135104434
1-[1-(quinolin-8-ylmethyl)piperidin-3-yl]ethanone
CID 63845455
(4R,5R)-7-[2-(2,3-dimethylphenoxy)ethyl]-4-methoxy-7-azaspiro[4.5]decane
CID 135109208

Frequently Asked Questions

What is the IUPAC name of 8-[[(4R,5R)-4-methoxy-7-azaspiro[4.5]decan-7-yl]methyl]quinoline?
The IUPAC name of 8-[[(4R,5R)-4-methoxy-7-azaspiro[4.5]decan-7-yl]methyl]quinoline (CID 165423233) is 8-[[(4R,5R)-4-methoxy-7-azaspiro[4.5]decan-7-yl]methyl]quinoline.
What is the SMILES notation for 8-[[(4R,5R)-4-methoxy-7-azaspiro[4.5]decan-7-yl]methyl]quinoline?
The canonical SMILES for 8-[[(4R,5R)-4-methoxy-7-azaspiro[4.5]decan-7-yl]methyl]quinoline is CO[C@@H]1CCC[C@]12CCCN(Cc1cccc3cccnc13)C2.
What is the InChIKey of 8-[[(4R,5R)-4-methoxy-7-azaspiro[4.5]decan-7-yl]methyl]quinoline?
The InChIKey is VJXPFKXFVFMGDM-UYAOXDASSA-N. The full InChI is InChI=1S/C20H26N2O/c1-23-18-9-3-10-20(18)11-5-13-22(15-20)14-17-7-2-6-16-8-4-12-21-19(16)17/h2,4,6-8,12,18H,3,5,9-11,13-15H2,1H3/t18-,20-/m1/s1.
What are the key properties of 8-[[(4R,5R)-4-methoxy-7-azaspiro[4.5]decan-7-yl]methyl]quinoline?
8-[[(4R,5R)-4-methoxy-7-azaspiro[4.5]decan-7-yl]methyl]quinoline has a molecular weight of 310.44 g/mol, XLogP of 4.02, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[[(4R,5R)-4-methoxy-7-azaspiro[4.5]decan-7-yl]methyl]quinoline is sourced from PubChem (CID 165423233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).