tert-butyl 8-amino-2-azaspiro[4.5]decane-2-carboxylate

C14H26N2O2 — CID 71630735

IUPACtert-butyl 8-amino-2-azaspiro[4.5]decane-2-carboxylate
SMILESCC(C)(C)OC(=O)N1CCC2(CCC(N)CC2)C1
InChIInChI=1S/C14H26N2O2/c1-13(2,3)18-12(17)16-9-8-14(10-16)6-4-11(15)5-7-14/h11H,4-10,15H2,1-3H3
InChIKeyXBDRCLQJGBXXHV-UHFFFAOYSA-N
MW254.37 g/mol
LogP2.51
Rot. Bonds

About tert-butyl 8-amino-2-azaspiro[4.5]decane-2-carboxylate

tert-butyl 8-amino-2-azaspiro[4.5]decane-2-carboxylate (PubChem CID 71630735) has the molecular formula C14H26N2O2 and a molecular weight of 254.37 g/mol. Its IUPAC name is tert-butyl 8-amino-2-azaspiro[4.5]decane-2-carboxylate.

Molecular Properties

Compound Nametert-butyl 8-amino-2-azaspiro[4.5]decane-2-carboxylate
PubChem CID71630735
Molecular FormulaC14H26N2O2
Molecular Weight254.37 g/mol
Exact Mass254.20
IUPAC Nametert-butyl 8-amino-2-azaspiro[4.5]decane-2-carboxylate
SMILESCC(C)(C)OC(=O)N1CCC2(CCC(N)CC2)C1
InChIInChI=1S/C14H26N2O2/c1-13(2,3)18-12(17)16-9-8-14(10-16)6-4-11(15)5-7-14/h11H,4-10,15H2,1-3H3
InChIKeyXBDRCLQJGBXXHV-UHFFFAOYSA-N
XLogP2.51
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze tert-butyl 8-amino-2-azaspiro[4.5]decane-2-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 2-amino-6-azaspiro[3.4]octane-6-carboxylate
CID 56962195
tert-butyl (5R)-8-hydroxy-2-azaspiro[4.4]nonane-2-carboxylate
CID 163302209
tert-butyl 8-carbamoyl-2-azaspiro[4.4]nonane-2-carboxylate
CID 167430090
tert-butyl 8-cyclohexyl-2,8-diazaspiro[4.5]decane-2-carboxylate
CID 68969463
tert-butyl (5R,7S,8R)-8-hydroxy-7-methyl-2-azaspiro[4.5]decane-2-carboxylate
CID 163396496
tert-butyl 2-methyl-6-azaspiro[3.4]octane-6-carboxylate
CID 144719040
tert-butyl 7-cyclopropyl-2,7-diazaspiro[4.4]nonane-2-carboxylate
CID 90426746
tert-butyl (7R,8R)-7-amino-8-fluoro-2-azaspiro[4.4]nonane-2-carboxylate
CID 135742686
tert-butyl 7-(aminomethyl)-2-azaspiro[4.5]decane-2-carboxylate
CID 82379496
tert-butyl 7-methyl-2,7-diazaspiro[4.4]nonane-2-carboxylate
CID 118994126
tert-butyl 8-cyano-2-azaspiro[4.4]nonane-2-carboxylate
CID 127263616
tert-butyl 9-amino-5-methyl-3-azaspiro[5.5]undecane-3-carboxylate
CID 155893864

Frequently Asked Questions

What is the IUPAC name of tert-butyl 8-amino-2-azaspiro[4.5]decane-2-carboxylate?
The IUPAC name of tert-butyl 8-amino-2-azaspiro[4.5]decane-2-carboxylate (CID 71630735) is tert-butyl 8-amino-2-azaspiro[4.5]decane-2-carboxylate.
What is the SMILES notation for tert-butyl 8-amino-2-azaspiro[4.5]decane-2-carboxylate?
The canonical SMILES for tert-butyl 8-amino-2-azaspiro[4.5]decane-2-carboxylate is CC(C)(C)OC(=O)N1CCC2(CCC(N)CC2)C1.
What is the InChIKey of tert-butyl 8-amino-2-azaspiro[4.5]decane-2-carboxylate?
The InChIKey is XBDRCLQJGBXXHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O2/c1-13(2,3)18-12(17)16-9-8-14(10-16)6-4-11(15)5-7-14/h11H,4-10,15H2,1-3H3.
What are the key properties of tert-butyl 8-amino-2-azaspiro[4.5]decane-2-carboxylate?
tert-butyl 8-amino-2-azaspiro[4.5]decane-2-carboxylate has a molecular weight of 254.37 g/mol, XLogP of 2.51, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl 8-amino-2-azaspiro[4.5]decane-2-carboxylate is sourced from PubChem (CID 71630735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).