(2-amino-5-oxaspiro[2.5]octan-2-yl)methanol

C8H15NO2 — CID 84650597

IUPAC(2-amino-5-oxaspiro[2.5]octan-2-yl)methanol
SMILESNC1(CO)CC12CCCOC2
InChIInChI=1S/C8H15NO2/c9-8(5-10)4-7(8)2-1-3-11-6-7/h10H,1-6,9H2
InChIKeyLJGFNTTUFGGTPP-UHFFFAOYSA-N
MW157.21 g/mol
LogP-0.12
Rot. Bonds1

About (2-amino-5-oxaspiro[2.5]octan-2-yl)methanol

(2-amino-5-oxaspiro[2.5]octan-2-yl)methanol (PubChem CID 84650597) has the molecular formula C8H15NO2 and a molecular weight of 157.21 g/mol. Its IUPAC name is (2-amino-5-oxaspiro[2.5]octan-2-yl)methanol.

Molecular Properties

Compound Name(2-amino-5-oxaspiro[2.5]octan-2-yl)methanol
PubChem CID84650597
Molecular FormulaC8H15NO2
Molecular Weight157.21 g/mol
Exact Mass157.11
IUPAC Name(2-amino-5-oxaspiro[2.5]octan-2-yl)methanol
SMILESNC1(CO)CC12CCCOC2
InChIInChI=1S/C8H15NO2/c9-8(5-10)4-7(8)2-1-3-11-6-7/h10H,1-6,9H2
InChIKeyLJGFNTTUFGGTPP-UHFFFAOYSA-N
XLogP-0.12
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.21
LogP ≤ 5-0.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2-amino-5-oxaspiro[2.5]octan-2-yl)methanol?
The IUPAC name of (2-amino-5-oxaspiro[2.5]octan-2-yl)methanol (CID 84650597) is (2-amino-5-oxaspiro[2.5]octan-2-yl)methanol.
What is the SMILES notation for (2-amino-5-oxaspiro[2.5]octan-2-yl)methanol?
The canonical SMILES for (2-amino-5-oxaspiro[2.5]octan-2-yl)methanol is NC1(CO)CC12CCCOC2.
What is the InChIKey of (2-amino-5-oxaspiro[2.5]octan-2-yl)methanol?
The InChIKey is LJGFNTTUFGGTPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO2/c9-8(5-10)4-7(8)2-1-3-11-6-7/h10H,1-6,9H2.
What are the key properties of (2-amino-5-oxaspiro[2.5]octan-2-yl)methanol?
(2-amino-5-oxaspiro[2.5]octan-2-yl)methanol has a molecular weight of 157.21 g/mol, XLogP of -0.12, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-amino-5-oxaspiro[2.5]octan-2-yl)methanol is sourced from PubChem (CID 84650597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).