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

C9H17NO2 — CID 106187086

IUPAC2-(5-azaspiro[2.3]hexan-5-yl)-3-methoxypropan-1-ol
SMILESCOCC(CO)N1CC2(CC2)C1
InChIInChI=1S/C9H17NO2/c1-12-5-8(4-11)10-6-9(7-10)2-3-9/h8,11H,2-7H2,1H3
InChIKeyISPFRPRSHDXGGR-UHFFFAOYSA-N
MW171.24 g/mol
LogP0.09
Rot. Bonds4

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

2-(5-azaspiro[2.3]hexan-5-yl)-3-methoxypropan-1-ol (PubChem CID 106187086) has the molecular formula C9H17NO2 and a molecular weight of 171.24 g/mol. Its IUPAC name is 2-(5-azaspiro[2.3]hexan-5-yl)-3-methoxypropan-1-ol.

Molecular Properties

Compound Name2-(5-azaspiro[2.3]hexan-5-yl)-3-methoxypropan-1-ol
PubChem CID106187086
Molecular FormulaC9H17NO2
Molecular Weight171.24 g/mol
Exact Mass171.13
IUPAC Name2-(5-azaspiro[2.3]hexan-5-yl)-3-methoxypropan-1-ol
SMILESCOCC(CO)N1CC2(CC2)C1
InChIInChI=1S/C9H17NO2/c1-12-5-8(4-11)10-6-9(7-10)2-3-9/h8,11H,2-7H2,1H3
InChIKeyISPFRPRSHDXGGR-UHFFFAOYSA-N
XLogP0.09
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.24
LogP ≤ 50.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-azaspiro[3.6]decan-2-yl)propane-1,3-diol
CID 104550086
2-(5-azaspiro[2.3]hexan-5-yl)-3-methoxypropanoic acid
CID 81082367
(2S)-2-(2-azaspiro[3.5]nonan-2-yl)butan-1-ol
CID 107861571
3-(3,3-diethylazetidin-1-yl)-4-methoxybutan-1-ol
CID 106159245
2-(2-azaspiro[3.6]decan-2-yl)-3-methoxypropanoic acid
CID 81082086
2-(5-azaspiro[2.3]hexan-5-yl)-4-methylpentan-1-amine
CID 79678047
2-(2-azaspiro[3.4]octan-2-yl)propan-1-ol
CID 104549199
(2S)-2-(2-azaspiro[3.5]nonan-2-yl)propan-1-ol
CID 104550126
4-(5-azaspiro[2.3]hexan-5-yl)pentan-2-amine
CID 130646251
1-(1-hydroxy-3-methoxypropan-2-yl)-3,4-dimethylpyrrole-2,5-dione
CID 106187036
4-(2-azaspiro[3.3]heptan-2-yl)-1-methoxybutan-2-ol
CID 106246282
3-(5-azaspiro[2.3]hexan-5-yl)-2-methylpropan-1-ol
CID 104549778

Frequently Asked Questions

What is the IUPAC name of 2-(5-azaspiro[2.3]hexan-5-yl)-3-methoxypropan-1-ol?
The IUPAC name of 2-(5-azaspiro[2.3]hexan-5-yl)-3-methoxypropan-1-ol (CID 106187086) is 2-(5-azaspiro[2.3]hexan-5-yl)-3-methoxypropan-1-ol.
What is the SMILES notation for 2-(5-azaspiro[2.3]hexan-5-yl)-3-methoxypropan-1-ol?
The canonical SMILES for 2-(5-azaspiro[2.3]hexan-5-yl)-3-methoxypropan-1-ol is COCC(CO)N1CC2(CC2)C1.
What is the InChIKey of 2-(5-azaspiro[2.3]hexan-5-yl)-3-methoxypropan-1-ol?
The InChIKey is ISPFRPRSHDXGGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO2/c1-12-5-8(4-11)10-6-9(7-10)2-3-9/h8,11H,2-7H2,1H3.
What are the key properties of 2-(5-azaspiro[2.3]hexan-5-yl)-3-methoxypropan-1-ol?
2-(5-azaspiro[2.3]hexan-5-yl)-3-methoxypropan-1-ol has a molecular weight of 171.24 g/mol, XLogP of 0.09, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-azaspiro[2.3]hexan-5-yl)-3-methoxypropan-1-ol is sourced from PubChem (CID 106187086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).