4-[3-(8,8-dipropyl-2-azaspiro[4.5]decan-2-yl)propyl]morpholine

C22H42N2O — CID 15634152

IUPAC4-[3-(8,8-dipropyl-2-azaspiro[4.5]decan-2-yl)propyl]morpholine
SMILESCCCC1(CCC)CCC2(CCN(CCCN3CCOCC3)C2)CC1
InChIInChI=1S/C22H42N2O/c1-3-6-21(7-4-2)8-10-22(11-9-21)12-15-24(20-22)14-5-13-23-16-18-25-19-17-23/h3-20H2,1-2H3
InChIKeyDUBUZWPTDBFHGL-UHFFFAOYSA-N
MW350.59 g/mol
LogP4.56
Rot. Bonds8

About 4-[3-(8,8-dipropyl-2-azaspiro[4.5]decan-2-yl)propyl]morpholine

4-[3-(8,8-dipropyl-2-azaspiro[4.5]decan-2-yl)propyl]morpholine (PubChem CID 15634152) has the molecular formula C22H42N2O and a molecular weight of 350.59 g/mol. Its IUPAC name is 4-[3-(8,8-dipropyl-2-azaspiro[4.5]decan-2-yl)propyl]morpholine.

Molecular Properties

Compound Name4-[3-(8,8-dipropyl-2-azaspiro[4.5]decan-2-yl)propyl]morpholine
PubChem CID15634152
Molecular FormulaC22H42N2O
Molecular Weight350.59 g/mol
Exact Mass350.33
IUPAC Name4-[3-(8,8-dipropyl-2-azaspiro[4.5]decan-2-yl)propyl]morpholine
SMILESCCCC1(CCC)CCC2(CCN(CCCN3CCOCC3)C2)CC1
InChIInChI=1S/C22H42N2O/c1-3-6-21(7-4-2)8-10-22(11-9-21)12-15-24(20-22)14-5-13-23-16-18-25-19-17-23/h3-20H2,1-2H3
InChIKeyDUBUZWPTDBFHGL-UHFFFAOYSA-N
XLogP4.56
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.59
LogP ≤ 54.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-[3-(9-Tert-butyl-3-azaspiro[5.5]undecan-3-yl)propyl]morpholine;hydrochloride
CID 54606301
4-[3-(8,8-Dipropyl-2-azaspiro[4.5]decan-2-yl)propyl]morpholine;hydrochloride
CID 49860529
4-[3-(3-Tert-butyl-9-azaspiro[5.5]undecan-9-yl)propyl]morpholine
CID 417420
4-[3-(4-Tert-butylcyclohexyl)-2-methylpropyl]-2,6-dimethylmorpholine
CID 12940609
4-[3-[(5R,7R)-7-(trifluoromethyl)-2-azaspiro[4.5]decan-2-yl]propyl]morpholine
CID 125485631
4-[3-[(5R,7S)-7-(trifluoromethyl)-2-azaspiro[4.5]decan-2-yl]propyl]morpholine
CID 125485632
4-[3-[(5S,7R)-7-(trifluoromethyl)-2-azaspiro[4.5]decan-2-yl]propyl]morpholine
CID 125485633
4-[3-[(5S,7S)-7-(trifluoromethyl)-2-azaspiro[4.5]decan-2-yl]propyl]morpholine
CID 125485634
4-[3-(9-Azaspiro[5.5]undecan-9-yl)propyl]morpholine
CID 417530
2-Cyclooctyl-7-(2-methoxyethyl)-2,7-diazaspiro[4.5]decane
CID 45185603
4-Methyl-4-[3-(3-methyl-3-azoniaspiro[5.5]undecan-3-yl)propyl]morpholin-4-ium iodide
CID 54610051
4-[3-(3-Azaspiro[5.5]undecan-3-yl)propyl]morpholine;hydrochloride
CID 54610052

Frequently Asked Questions

What is the IUPAC name of 4-[3-(8,8-dipropyl-2-azaspiro[4.5]decan-2-yl)propyl]morpholine?
The IUPAC name of 4-[3-(8,8-dipropyl-2-azaspiro[4.5]decan-2-yl)propyl]morpholine (CID 15634152) is 4-[3-(8,8-dipropyl-2-azaspiro[4.5]decan-2-yl)propyl]morpholine.
What is the SMILES notation for 4-[3-(8,8-dipropyl-2-azaspiro[4.5]decan-2-yl)propyl]morpholine?
The canonical SMILES for 4-[3-(8,8-dipropyl-2-azaspiro[4.5]decan-2-yl)propyl]morpholine is CCCC1(CCC)CCC2(CCN(CCCN3CCOCC3)C2)CC1.
What is the InChIKey of 4-[3-(8,8-dipropyl-2-azaspiro[4.5]decan-2-yl)propyl]morpholine?
The InChIKey is DUBUZWPTDBFHGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H42N2O/c1-3-6-21(7-4-2)8-10-22(11-9-21)12-15-24(20-22)14-5-13-23-16-18-25-19-17-23/h3-20H2,1-2H3.
What are the key properties of 4-[3-(8,8-dipropyl-2-azaspiro[4.5]decan-2-yl)propyl]morpholine?
4-[3-(8,8-dipropyl-2-azaspiro[4.5]decan-2-yl)propyl]morpholine has a molecular weight of 350.59 g/mol, XLogP of 4.56, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(8,8-dipropyl-2-azaspiro[4.5]decan-2-yl)propyl]morpholine is sourced from PubChem (CID 15634152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).