tert-butyl 3-morpholin-4-yl-8-azaspiro[4.5]decane-8-carboxylate

C18H32N2O3 — CID 169144108

IUPACtert-butyl 3-morpholin-4-yl-8-azaspiro[4.5]decane-8-carboxylate
SMILESCC(C)(C)OC(=O)N1CCC2(CCC(N3CCOCC3)C2)CC1
InChIInChI=1S/C18H32N2O3/c1-17(2,3)23-16(21)20-8-6-18(7-9-20)5-4-15(14-18)19-10-12-22-13-11-19/h15H,4-14H2,1-3H3
InChIKeyLHZSIJJEVUYJLJ-UHFFFAOYSA-N
MW324.46 g/mol
LogP2.89
Rot. Bonds1

About tert-butyl 3-morpholin-4-yl-8-azaspiro[4.5]decane-8-carboxylate

tert-butyl 3-morpholin-4-yl-8-azaspiro[4.5]decane-8-carboxylate (PubChem CID 169144108) has the molecular formula C18H32N2O3 and a molecular weight of 324.46 g/mol. Its IUPAC name is tert-butyl 3-morpholin-4-yl-8-azaspiro[4.5]decane-8-carboxylate.

Molecular Properties

Compound Nametert-butyl 3-morpholin-4-yl-8-azaspiro[4.5]decane-8-carboxylate
PubChem CID169144108
Molecular FormulaC18H32N2O3
Molecular Weight324.46 g/mol
Exact Mass324.24
IUPAC Nametert-butyl 3-morpholin-4-yl-8-azaspiro[4.5]decane-8-carboxylate
SMILESCC(C)(C)OC(=O)N1CCC2(CCC(N3CCOCC3)C2)CC1
InChIInChI=1S/C18H32N2O3/c1-17(2,3)23-16(21)20-8-6-18(7-9-20)5-4-15(14-18)19-10-12-22-13-11-19/h15H,4-14H2,1-3H3
InChIKeyLHZSIJJEVUYJLJ-UHFFFAOYSA-N
XLogP2.89
TPSA42.01 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.46
LogP ≤ 52.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze tert-butyl 3-morpholin-4-yl-8-azaspiro[4.5]decane-8-carboxylate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

tert-butyl 9-(azetidin-1-yl)-3-azaspiro[5.5]undecane-3-carboxylate
CID 66850495
tert-butyl 3'-morpholin-4-ylspiro[8-azabicyclo[3.2.1]octane-3,1'-cyclobutane]-8-carboxylate
CID 175929655
tert-butyl 3-morpholin-4-yl-7-azaspiro[3.5]nonane-7-carboxylate
CID 176884220
tert-butyl (3R)-3-(hydroxymethyl)-8-azaspiro[4.5]decane-8-carboxylate
CID 124896537
tert-butyl 4-(oxan-4-yl)-1-oxa-4,9-diazaspiro[5.5]undecane-9-carboxylate
CID 169160969
tert-butyl 2-(1,1-dioxo-1,4-thiazinan-4-yl)-7-azaspiro[3.5]nonane-7-carboxylate
CID 142518188
tert-butyl 9-bromo-3-azaspiro[5.5]undecane-3-carboxylate
CID 156503670
tert-butyl 6-azaspiro[2.5]octane-6-carboxylate;methane
CID 177036398
3-O-tert-butyl 10-O-methyl 3-azaspiro[5.5]undecane-3,10-dicarboxylate
CID 171921915
tert-butyl (6R)-6-[4-[2-(oxan-4-yl)phenyl]piperidin-1-yl]-2-azaspiro[3.4]octane-2-carboxylate;(6R)-6-[4-[2-(oxan-4-yl)phenyl]piperidin-1-yl]-2-azaspiro[3.4]octane
CID 175777384
tert-butyl 8-cyclohexyl-2,8-diazaspiro[4.5]decane-2-carboxylate
CID 68969463
tert-butyl 7-azaspiro[3.5]nonane-7-carboxylate
CID 130609664

Frequently Asked Questions

What is the IUPAC name of tert-butyl 3-morpholin-4-yl-8-azaspiro[4.5]decane-8-carboxylate?
The IUPAC name of tert-butyl 3-morpholin-4-yl-8-azaspiro[4.5]decane-8-carboxylate (CID 169144108) is tert-butyl 3-morpholin-4-yl-8-azaspiro[4.5]decane-8-carboxylate.
What is the SMILES notation for tert-butyl 3-morpholin-4-yl-8-azaspiro[4.5]decane-8-carboxylate?
The canonical SMILES for tert-butyl 3-morpholin-4-yl-8-azaspiro[4.5]decane-8-carboxylate is CC(C)(C)OC(=O)N1CCC2(CCC(N3CCOCC3)C2)CC1.
What is the InChIKey of tert-butyl 3-morpholin-4-yl-8-azaspiro[4.5]decane-8-carboxylate?
The InChIKey is LHZSIJJEVUYJLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H32N2O3/c1-17(2,3)23-16(21)20-8-6-18(7-9-20)5-4-15(14-18)19-10-12-22-13-11-19/h15H,4-14H2,1-3H3.
What are the key properties of tert-butyl 3-morpholin-4-yl-8-azaspiro[4.5]decane-8-carboxylate?
tert-butyl 3-morpholin-4-yl-8-azaspiro[4.5]decane-8-carboxylate has a molecular weight of 324.46 g/mol, XLogP of 2.89, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl 3-morpholin-4-yl-8-azaspiro[4.5]decane-8-carboxylate is sourced from PubChem (CID 169144108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).