(7S)-7-hydroxy-4-azaspiro[2.5]octan-5-one

C7H11NO2 — CID 129499410

IUPAC(7S)-7-hydroxy-4-azaspiro[2.5]octan-5-one
SMILESO=C1C[C@@H](O)CC2(CC2)N1
InChIInChI=1S/C7H11NO2/c9-5-3-6(10)8-7(4-5)1-2-7/h5,9H,1-4H2,(H,8,10)/t5-/m1/s1
InChIKeyJPHZGICXITZVJY-RXMQYKEDSA-N
MW141.17 g/mol
LogP-0.21
Rot. Bonds

About (7S)-7-hydroxy-4-azaspiro[2.5]octan-5-one

(7S)-7-hydroxy-4-azaspiro[2.5]octan-5-one (PubChem CID 129499410) has the molecular formula C7H11NO2 and a molecular weight of 141.17 g/mol. Its IUPAC name is (7S)-7-hydroxy-4-azaspiro[2.5]octan-5-one.

Molecular Properties

Compound Name(7S)-7-hydroxy-4-azaspiro[2.5]octan-5-one
PubChem CID129499410
Molecular FormulaC7H11NO2
Molecular Weight141.17 g/mol
Exact Mass141.08
IUPAC Name(7S)-7-hydroxy-4-azaspiro[2.5]octan-5-one
SMILESO=C1C[C@@H](O)CC2(CC2)N1
InChIInChI=1S/C7H11NO2/c9-5-3-6(10)8-7(4-5)1-2-7/h5,9H,1-4H2,(H,8,10)/t5-/m1/s1
InChIKeyJPHZGICXITZVJY-RXMQYKEDSA-N
XLogP-0.21
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.17
LogP ≤ 5-0.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (7S)-7-hydroxy-4-azaspiro[2.5]octan-5-one?
The IUPAC name of (7S)-7-hydroxy-4-azaspiro[2.5]octan-5-one (CID 129499410) is (7S)-7-hydroxy-4-azaspiro[2.5]octan-5-one.
What is the SMILES notation for (7S)-7-hydroxy-4-azaspiro[2.5]octan-5-one?
The canonical SMILES for (7S)-7-hydroxy-4-azaspiro[2.5]octan-5-one is O=C1C[C@@H](O)CC2(CC2)N1.
What is the InChIKey of (7S)-7-hydroxy-4-azaspiro[2.5]octan-5-one?
The InChIKey is JPHZGICXITZVJY-RXMQYKEDSA-N. The full InChI is InChI=1S/C7H11NO2/c9-5-3-6(10)8-7(4-5)1-2-7/h5,9H,1-4H2,(H,8,10)/t5-/m1/s1.
What are the key properties of (7S)-7-hydroxy-4-azaspiro[2.5]octan-5-one?
(7S)-7-hydroxy-4-azaspiro[2.5]octan-5-one has a molecular weight of 141.17 g/mol, XLogP of -0.21, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (7S)-7-hydroxy-4-azaspiro[2.5]octan-5-one is sourced from PubChem (CID 129499410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).