2-amino-6-azaspiro[3.4]octan-5-one

C7H12N2O — CID 134819068

IUPAC2-amino-6-azaspiro[3.4]octan-5-one
SMILESNC1CC2(CCNC2=O)C1
InChIInChI=1S/C7H12N2O/c8-5-3-7(4-5)1-2-9-6(7)10/h5H,1-4,8H2,(H,9,10)
InChIKeyIXOAVPNFUUDKLB-UHFFFAOYSA-N
MW140.19 g/mol
LogP-0.39
Rot. Bonds

About 2-amino-6-azaspiro[3.4]octan-5-one

2-amino-6-azaspiro[3.4]octan-5-one (PubChem CID 134819068) has the molecular formula C7H12N2O and a molecular weight of 140.19 g/mol. Its IUPAC name is 2-amino-6-azaspiro[3.4]octan-5-one.

Molecular Properties

Compound Name2-amino-6-azaspiro[3.4]octan-5-one
PubChem CID134819068
Molecular FormulaC7H12N2O
Molecular Weight140.19 g/mol
Exact Mass140.09
IUPAC Name2-amino-6-azaspiro[3.4]octan-5-one
SMILESNC1CC2(CCNC2=O)C1
InChIInChI=1S/C7H12N2O/c8-5-3-7(4-5)1-2-9-6(7)10/h5H,1-4,8H2,(H,9,10)
InChIKeyIXOAVPNFUUDKLB-UHFFFAOYSA-N
XLogP-0.39
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.19
LogP ≤ 5-0.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-amino-6-azaspiro[3.4]octan-5-one?
The IUPAC name of 2-amino-6-azaspiro[3.4]octan-5-one (CID 134819068) is 2-amino-6-azaspiro[3.4]octan-5-one.
What is the SMILES notation for 2-amino-6-azaspiro[3.4]octan-5-one?
The canonical SMILES for 2-amino-6-azaspiro[3.4]octan-5-one is NC1CC2(CCNC2=O)C1.
What is the InChIKey of 2-amino-6-azaspiro[3.4]octan-5-one?
The InChIKey is IXOAVPNFUUDKLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2O/c8-5-3-7(4-5)1-2-9-6(7)10/h5H,1-4,8H2,(H,9,10).
What are the key properties of 2-amino-6-azaspiro[3.4]octan-5-one?
2-amino-6-azaspiro[3.4]octan-5-one has a molecular weight of 140.19 g/mol, XLogP of -0.39, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-azaspiro[3.4]octan-5-one is sourced from PubChem (CID 134819068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).