tert-butyl 6-hydroxy-2-azaspiro[4.5]decane-2-carboxylate

C14H25NO3 — CID 135395733

IUPACtert-butyl 6-hydroxy-2-azaspiro[4.5]decane-2-carboxylate
SMILESCC(C)(C)OC(=O)N1CCC2(CCCCC2O)C1
InChIInChI=1S/C14H25NO3/c1-13(2,3)18-12(17)15-9-8-14(10-15)7-5-4-6-11(14)16/h11,16H,4-10H2,1-3H3
InChIKeySGGYJRWNTKDNSL-UHFFFAOYSA-N
MW255.36 g/mol
LogP2.55
Rot. Bonds

About tert-butyl 6-hydroxy-2-azaspiro[4.5]decane-2-carboxylate

tert-butyl 6-hydroxy-2-azaspiro[4.5]decane-2-carboxylate (PubChem CID 135395733) has the molecular formula C14H25NO3 and a molecular weight of 255.36 g/mol. Its IUPAC name is tert-butyl 6-hydroxy-2-azaspiro[4.5]decane-2-carboxylate.

Molecular Properties

Compound Nametert-butyl 6-hydroxy-2-azaspiro[4.5]decane-2-carboxylate
PubChem CID135395733
Molecular FormulaC14H25NO3
Molecular Weight255.36 g/mol
Exact Mass255.18
IUPAC Nametert-butyl 6-hydroxy-2-azaspiro[4.5]decane-2-carboxylate
SMILESCC(C)(C)OC(=O)N1CCC2(CCCCC2O)C1
InChIInChI=1S/C14H25NO3/c1-13(2,3)18-12(17)15-9-8-14(10-15)7-5-4-6-11(14)16/h11,16H,4-10H2,1-3H3
InChIKeySGGYJRWNTKDNSL-UHFFFAOYSA-N
XLogP2.55
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

tert-butyl (5S,9S)-9-hydroxy-2-azaspiro[4.4]nonane-2-carboxylate
CID 124555987
tert-butyl 11-amino-2-azaspiro[5.5]undecane-2-carboxylate
CID 82667309
6-[(2-methylpropan-2-yl)oxycarbonyl]-6-azaspiro[3.4]octane-3-carboxylic acid
CID 129317695
tert-butyl (3R,4S)-3-amino-6-azaspiro[3.5]nonane-6-carboxylate
CID 97294860
tert-butyl 4-hydroxy-2,7-diazaspiro[4.5]decane-7-carboxylate
CID 83488546
tert-butyl 6-[[3-(hydroxymethyl)cyclobutyl]amino]-2-azaspiro[4.5]decane-2-carboxylate
CID 154776091
tert-butyl 10-hydroxy-2,6-diazaspiro[4.5]decane-2-carboxylate;hydrochloride
CID 115053003
tert-butyl 10-amino-7-oxa-2-azaspiro[4.5]decane-2-carboxylate
CID 82380603
tert-butyl 5-amino-3-azaspiro[5.5]undecane-3-carboxylate
CID 76850181
tert-butyl 5-hydroxy-2,8-diazaspiro[3.5]nonane-2-carboxylate
CID 82386806
tert-butyl (8S)-8-amino-5-azaspiro[2.5]octane-5-carboxylate
CID 86332345
tert-butyl (4aR,8aR)-8a-hydroxy-1,3,4,4a,5,6,7,8-octahydroisoquinoline-2-carboxylate
CID 178203012

Frequently Asked Questions

What is the IUPAC name of tert-butyl 6-hydroxy-2-azaspiro[4.5]decane-2-carboxylate?
The IUPAC name of tert-butyl 6-hydroxy-2-azaspiro[4.5]decane-2-carboxylate (CID 135395733) is tert-butyl 6-hydroxy-2-azaspiro[4.5]decane-2-carboxylate.
What is the SMILES notation for tert-butyl 6-hydroxy-2-azaspiro[4.5]decane-2-carboxylate?
The canonical SMILES for tert-butyl 6-hydroxy-2-azaspiro[4.5]decane-2-carboxylate is CC(C)(C)OC(=O)N1CCC2(CCCCC2O)C1.
What is the InChIKey of tert-butyl 6-hydroxy-2-azaspiro[4.5]decane-2-carboxylate?
The InChIKey is SGGYJRWNTKDNSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO3/c1-13(2,3)18-12(17)15-9-8-14(10-15)7-5-4-6-11(14)16/h11,16H,4-10H2,1-3H3.
What are the key properties of tert-butyl 6-hydroxy-2-azaspiro[4.5]decane-2-carboxylate?
tert-butyl 6-hydroxy-2-azaspiro[4.5]decane-2-carboxylate has a molecular weight of 255.36 g/mol, XLogP of 2.55, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl 6-hydroxy-2-azaspiro[4.5]decane-2-carboxylate is sourced from PubChem (CID 135395733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).