3-(5-azaspiro[2.3]hexan-5-ylmethyl)pentan-3-ol

C11H21NO — CID 104549859

IUPAC3-(5-azaspiro[2.3]hexan-5-ylmethyl)pentan-3-ol
SMILESCCC(O)(CC)CN1CC2(CC2)C1
InChIInChI=1S/C11H21NO/c1-3-11(13,4-2)9-12-7-10(8-12)5-6-10/h13H,3-9H2,1-2H3
InChIKeyGOROXCICSPQLPH-UHFFFAOYSA-N
MW183.29 g/mol
LogP1.63
Rot. Bonds4

About 3-(5-azaspiro[2.3]hexan-5-ylmethyl)pentan-3-ol

3-(5-azaspiro[2.3]hexan-5-ylmethyl)pentan-3-ol (PubChem CID 104549859) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is 3-(5-azaspiro[2.3]hexan-5-ylmethyl)pentan-3-ol.

Molecular Properties

Compound Name3-(5-azaspiro[2.3]hexan-5-ylmethyl)pentan-3-ol
PubChem CID104549859
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Name3-(5-azaspiro[2.3]hexan-5-ylmethyl)pentan-3-ol
SMILESCCC(O)(CC)CN1CC2(CC2)C1
InChIInChI=1S/C11H21NO/c1-3-11(13,4-2)9-12-7-10(8-12)5-6-10/h13H,3-9H2,1-2H3
InChIKeyGOROXCICSPQLPH-UHFFFAOYSA-N
XLogP1.63
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[(4,4-diethylpiperidin-1-yl)methyl]pentan-3-ol
CID 114495612
3-(2-azaspiro[3.3]heptan-2-ylmethyl)pentan-3-amine
CID 115306385
3-(5-azaspiro[2.3]hexan-5-yl)-2,2-dimethylpropan-1-ol
CID 104550659
2-(2,2-dimethylpropyl)-2-azaspiro[3.3]heptane
CID 90140966
3-[[(2R,6S)-2,6-dimethylmorpholin-4-yl]methyl]pentan-3-ol
CID 103936738
3-(2-azaspiro[3.3]heptan-2-yl)-2-methylpropane-1,2-diol
CID 104550414
2-[4-(2-ethyl-2-hydroxybutyl)piperazin-1-yl]acetonitrile
CID 115928549
3-[[4-(1-hydroxyethyl)piperidin-1-yl]methyl]pentan-3-ol
CID 103935797
2-cyclopropyl-7-ethyl-2,7-diazaspiro[4.4]nonane
CID 145006598
1-(2-ethyl-2-hydroxybutyl)piperidin-3-ol
CID 115919280
2-ethyl-2-azaspiro[3.3]heptane
CID 130337259
2-(2-azaspiro[3.4]octan-2-yl)-2-ethylpropane-1,3-diol
CID 107866921

Frequently Asked Questions

What is the IUPAC name of 3-(5-azaspiro[2.3]hexan-5-ylmethyl)pentan-3-ol?
The IUPAC name of 3-(5-azaspiro[2.3]hexan-5-ylmethyl)pentan-3-ol (CID 104549859) is 3-(5-azaspiro[2.3]hexan-5-ylmethyl)pentan-3-ol.
What is the SMILES notation for 3-(5-azaspiro[2.3]hexan-5-ylmethyl)pentan-3-ol?
The canonical SMILES for 3-(5-azaspiro[2.3]hexan-5-ylmethyl)pentan-3-ol is CCC(O)(CC)CN1CC2(CC2)C1.
What is the InChIKey of 3-(5-azaspiro[2.3]hexan-5-ylmethyl)pentan-3-ol?
The InChIKey is GOROXCICSPQLPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-3-11(13,4-2)9-12-7-10(8-12)5-6-10/h13H,3-9H2,1-2H3.
What are the key properties of 3-(5-azaspiro[2.3]hexan-5-ylmethyl)pentan-3-ol?
3-(5-azaspiro[2.3]hexan-5-ylmethyl)pentan-3-ol has a molecular weight of 183.29 g/mol, XLogP of 1.63, 4 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-ylmethyl)pentan-3-ol is sourced from PubChem (CID 104549859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).