3-(8-azaspiro[4.5]decan-8-yl)butan-2-ol

C13H25NO — CID 63158941

IUPAC3-(8-azaspiro[4.5]decan-8-yl)butan-2-ol
SMILESCC(O)C(C)N1CCC2(CCCC2)CC1
InChIInChI=1S/C13H25NO/c1-11(12(2)15)14-9-7-13(8-10-14)5-3-4-6-13/h11-12,15H,3-10H2,1-2H3
InChIKeySQHLDONGJREONA-UHFFFAOYSA-N
MW211.35 g/mol
LogP2.41
Rot. Bonds2

About 3-(8-azaspiro[4.5]decan-8-yl)butan-2-ol

3-(8-azaspiro[4.5]decan-8-yl)butan-2-ol (PubChem CID 63158941) has the molecular formula C13H25NO and a molecular weight of 211.35 g/mol. Its IUPAC name is 3-(8-azaspiro[4.5]decan-8-yl)butan-2-ol.

Molecular Properties

Compound Name3-(8-azaspiro[4.5]decan-8-yl)butan-2-ol
PubChem CID63158941
Molecular FormulaC13H25NO
Molecular Weight211.35 g/mol
Exact Mass211.19
IUPAC Name3-(8-azaspiro[4.5]decan-8-yl)butan-2-ol
SMILESCC(O)C(C)N1CCC2(CCCC2)CC1
InChIInChI=1S/C13H25NO/c1-11(12(2)15)14-9-7-13(8-10-14)5-3-4-6-13/h11-12,15H,3-10H2,1-2H3
InChIKeySQHLDONGJREONA-UHFFFAOYSA-N
XLogP2.41
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.35
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S,3R)-3-pyrrolidin-1-ylbutan-2-ol
CID 59057792
(2R,3R)-3-piperidin-1-ylbutan-2-ol
CID 51980607
1-(3-hydroxybutan-2-yl)-4-methylazepan-4-ol
CID 107407212
methyl 3-(3-azaspiro[5.5]undecan-3-yl)-2-methylbutanoate
CID 79414044
3-(8-azaspiro[4.5]decan-8-yl)-2-methyl-N-propan-2-ylbutan-1-amine
CID 79409918
3-(8-azaspiro[4.5]decan-8-yl)-N,2-dimethylbutan-1-amine
CID 79409713
2-(8-azaspiro[4.5]decan-8-yl)-3-methylbutan-1-amine
CID 63157149
3-(8-azaspiro[4.5]decan-8-yl)butanoic acid
CID 63158284
1-(3-hydroxybutan-2-yl)-3-methylpiperidin-3-ol
CID 115874049
2-(3-azaspiro[5.5]undecan-3-yl)-N'-hydroxypropanimidamide
CID 76981163
2-(8-azaspiro[4.5]decan-8-yl)-N-methylpropan-1-amine
CID 63163571
ethane;2-propan-2-yl-2-azaspiro[4.5]decane
CID 144877753

Frequently Asked Questions

What is the IUPAC name of 3-(8-azaspiro[4.5]decan-8-yl)butan-2-ol?
The IUPAC name of 3-(8-azaspiro[4.5]decan-8-yl)butan-2-ol (CID 63158941) is 3-(8-azaspiro[4.5]decan-8-yl)butan-2-ol.
What is the SMILES notation for 3-(8-azaspiro[4.5]decan-8-yl)butan-2-ol?
The canonical SMILES for 3-(8-azaspiro[4.5]decan-8-yl)butan-2-ol is CC(O)C(C)N1CCC2(CCCC2)CC1.
What is the InChIKey of 3-(8-azaspiro[4.5]decan-8-yl)butan-2-ol?
The InChIKey is SQHLDONGJREONA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO/c1-11(12(2)15)14-9-7-13(8-10-14)5-3-4-6-13/h11-12,15H,3-10H2,1-2H3.
What are the key properties of 3-(8-azaspiro[4.5]decan-8-yl)butan-2-ol?
3-(8-azaspiro[4.5]decan-8-yl)butan-2-ol has a molecular weight of 211.35 g/mol, XLogP of 2.41, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(8-azaspiro[4.5]decan-8-yl)butan-2-ol is sourced from PubChem (CID 63158941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).