3-(5-azaspiro[2.3]hexan-5-yl)-2,2-dimethylpropan-1-ol

C10H19NO — CID 104550659

IUPAC3-(5-azaspiro[2.3]hexan-5-yl)-2,2-dimethylpropan-1-ol
SMILESCC(C)(CO)CN1CC2(CC2)C1
InChIInChI=1S/C10H19NO/c1-9(2,8-12)5-11-6-10(7-11)3-4-10/h12H,3-8H2,1-2H3
InChIKeyVOKWVBWUQRCAIC-UHFFFAOYSA-N
MW169.27 g/mol
LogP1.10
Rot. Bonds3

About 3-(5-azaspiro[2.3]hexan-5-yl)-2,2-dimethylpropan-1-ol

3-(5-azaspiro[2.3]hexan-5-yl)-2,2-dimethylpropan-1-ol (PubChem CID 104550659) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is 3-(5-azaspiro[2.3]hexan-5-yl)-2,2-dimethylpropan-1-ol.

Molecular Properties

Compound Name3-(5-azaspiro[2.3]hexan-5-yl)-2,2-dimethylpropan-1-ol
PubChem CID104550659
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name3-(5-azaspiro[2.3]hexan-5-yl)-2,2-dimethylpropan-1-ol
SMILESCC(C)(CO)CN1CC2(CC2)C1
InChIInChI=1S/C10H19NO/c1-9(2,8-12)5-11-6-10(7-11)3-4-10/h12H,3-8H2,1-2H3
InChIKeyVOKWVBWUQRCAIC-UHFFFAOYSA-N
XLogP1.10
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(5-azaspiro[2.3]hexan-5-yl)-2,2-dimethylpropan-1-ol?
The IUPAC name of 3-(5-azaspiro[2.3]hexan-5-yl)-2,2-dimethylpropan-1-ol (CID 104550659) is 3-(5-azaspiro[2.3]hexan-5-yl)-2,2-dimethylpropan-1-ol.
What is the SMILES notation for 3-(5-azaspiro[2.3]hexan-5-yl)-2,2-dimethylpropan-1-ol?
The canonical SMILES for 3-(5-azaspiro[2.3]hexan-5-yl)-2,2-dimethylpropan-1-ol is CC(C)(CO)CN1CC2(CC2)C1.
What is the InChIKey of 3-(5-azaspiro[2.3]hexan-5-yl)-2,2-dimethylpropan-1-ol?
The InChIKey is VOKWVBWUQRCAIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1-9(2,8-12)5-11-6-10(7-11)3-4-10/h12H,3-8H2,1-2H3.
What are the key properties of 3-(5-azaspiro[2.3]hexan-5-yl)-2,2-dimethylpropan-1-ol?
3-(5-azaspiro[2.3]hexan-5-yl)-2,2-dimethylpropan-1-ol has a molecular weight of 169.27 g/mol, XLogP of 1.10, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-azaspiro[2.3]hexan-5-yl)-2,2-dimethylpropan-1-ol is sourced from PubChem (CID 104550659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).