tert-butyl N-[(4R)-2-oxa-8-azaspiro[4.5]decan-4-yl]carbamate

C13H24N2O3 — CID 155904737

IUPACtert-butyl N-[(4R)-2-oxa-8-azaspiro[4.5]decan-4-yl]carbamate
SMILESCC(C)(C)OC(=O)N[C@H]1COCC12CCNCC2
InChIInChI=1S/C13H24N2O3/c1-12(2,3)18-11(16)15-10-8-17-9-13(10)4-6-14-7-5-13/h10,14H,4-9H2,1-3H3,(H,15,16)/t10-/m0/s1
InChIKeyKHVXQKCRFSXIID-JTQLQIEISA-N
MW256.35 g/mol
LogP1.28
Rot. Bonds1

About tert-butyl N-[(4R)-2-oxa-8-azaspiro[4.5]decan-4-yl]carbamate

tert-butyl N-[(4R)-2-oxa-8-azaspiro[4.5]decan-4-yl]carbamate (PubChem CID 155904737) has the molecular formula C13H24N2O3 and a molecular weight of 256.35 g/mol. Its IUPAC name is tert-butyl N-[(4R)-2-oxa-8-azaspiro[4.5]decan-4-yl]carbamate.

Molecular Properties

Compound Nametert-butyl N-[(4R)-2-oxa-8-azaspiro[4.5]decan-4-yl]carbamate
PubChem CID155904737
Molecular FormulaC13H24N2O3
Molecular Weight256.35 g/mol
Exact Mass256.18
IUPAC Nametert-butyl N-[(4R)-2-oxa-8-azaspiro[4.5]decan-4-yl]carbamate
SMILESCC(C)(C)OC(=O)N[C@H]1COCC12CCNCC2
InChIInChI=1S/C13H24N2O3/c1-12(2,3)18-11(16)15-10-8-17-9-13(10)4-6-14-7-5-13/h10,14H,4-9H2,1-3H3,(H,15,16)/t10-/m0/s1
InChIKeyKHVXQKCRFSXIID-JTQLQIEISA-N
XLogP1.28
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 51.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze tert-butyl N-[(4R)-2-oxa-8-azaspiro[4.5]decan-4-yl]carbamate 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 N-[(3R,4R)-6-azaspiro[3.4]octan-3-yl]carbamate
CID 97294998
tert-butyl N-(8-azaspiro[4.5]decan-4-yl)carbamate
CID 127264221
tert-butyl N-(8-azaspiro[4.5]decan-10-yl)carbamate
CID 83680565
tert-butyl N-[(3R,4S)-4-hydroxy-4-methyloxolan-3-yl]carbamate
CID 157038702
tert-butyl N-[(3R,4S)-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-yl]carbamate
CID 139427232
tert-butyl N-(6-azaspiro[3.5]nonan-9-yl)carbamate;hydrochloride
CID 138040815
tert-butyl N-[(4R)-3,3-dimethylpiperidin-4-yl]carbamate
CID 92980395
tert-butyl N-[(2S)-spiro[2.4]heptan-2-yl]carbamate
CID 98042480
tert-butyl N-[(3S,4S)-4-[(2-methylpropan-2-yl)oxycarbonylamino]pyrrolidin-3-yl]carbamate
CID 24728871
tert-butyl N-[(3S)-4,4-dimethylpyrrolidin-3-yl]carbamate
CID 45092197
tert-butyl N-[(5S,7R)-2-azaspiro[4.5]decan-7-yl]carbamate
CID 97299724
tert-butyl N-spiro[2.5]octan-2-ylcarbamate
CID 86276839

Frequently Asked Questions

What is the IUPAC name of tert-butyl N-[(4R)-2-oxa-8-azaspiro[4.5]decan-4-yl]carbamate?
The IUPAC name of tert-butyl N-[(4R)-2-oxa-8-azaspiro[4.5]decan-4-yl]carbamate (CID 155904737) is tert-butyl N-[(4R)-2-oxa-8-azaspiro[4.5]decan-4-yl]carbamate.
What is the SMILES notation for tert-butyl N-[(4R)-2-oxa-8-azaspiro[4.5]decan-4-yl]carbamate?
The canonical SMILES for tert-butyl N-[(4R)-2-oxa-8-azaspiro[4.5]decan-4-yl]carbamate is CC(C)(C)OC(=O)N[C@H]1COCC12CCNCC2.
What is the InChIKey of tert-butyl N-[(4R)-2-oxa-8-azaspiro[4.5]decan-4-yl]carbamate?
The InChIKey is KHVXQKCRFSXIID-JTQLQIEISA-N. The full InChI is InChI=1S/C13H24N2O3/c1-12(2,3)18-11(16)15-10-8-17-9-13(10)4-6-14-7-5-13/h10,14H,4-9H2,1-3H3,(H,15,16)/t10-/m0/s1.
What are the key properties of tert-butyl N-[(4R)-2-oxa-8-azaspiro[4.5]decan-4-yl]carbamate?
tert-butyl N-[(4R)-2-oxa-8-azaspiro[4.5]decan-4-yl]carbamate has a molecular weight of 256.35 g/mol, XLogP of 1.28, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-[(4R)-2-oxa-8-azaspiro[4.5]decan-4-yl]carbamate is sourced from PubChem (CID 155904737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).