2-[1-oxaspiro[4.5]decan-2-ylmethyl(propan-2-yl)amino]ethanol

C15H29NO2 — CID 102848066

IUPAC2-[1-oxaspiro[4.5]decan-2-ylmethyl(propan-2-yl)amino]ethanol
SMILESCC(C)N(CCO)CC1CCC2(CCCCC2)O1
InChIInChI=1S/C15H29NO2/c1-13(2)16(10-11-17)12-14-6-9-15(18-14)7-4-3-5-8-15/h13-14,17H,3-12H2,1-2H3
InChIKeyVBRPCWXAJQNOPZ-UHFFFAOYSA-N
MW255.40 g/mol
LogP2.57
Rot. Bonds5

About 2-[1-oxaspiro[4.5]decan-2-ylmethyl(propan-2-yl)amino]ethanol

2-[1-oxaspiro[4.5]decan-2-ylmethyl(propan-2-yl)amino]ethanol (PubChem CID 102848066) has the molecular formula C15H29NO2 and a molecular weight of 255.40 g/mol. Its IUPAC name is 2-[1-oxaspiro[4.5]decan-2-ylmethyl(propan-2-yl)amino]ethanol.

Molecular Properties

Compound Name2-[1-oxaspiro[4.5]decan-2-ylmethyl(propan-2-yl)amino]ethanol
PubChem CID102848066
Molecular FormulaC15H29NO2
Molecular Weight255.40 g/mol
Exact Mass255.22
IUPAC Name2-[1-oxaspiro[4.5]decan-2-ylmethyl(propan-2-yl)amino]ethanol
SMILESCC(C)N(CCO)CC1CCC2(CCCCC2)O1
InChIInChI=1S/C15H29NO2/c1-13(2)16(10-11-17)12-14-6-9-15(18-14)7-4-3-5-8-15/h13-14,17H,3-12H2,1-2H3
InChIKeyVBRPCWXAJQNOPZ-UHFFFAOYSA-N
XLogP2.57
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.40
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[4-[Methyl-[2-[(2-methylpropan-2-yl)oxy]ethyl]amino]cyclohexyl]methanol
CID 84591952
2-[1-Oxaspiro[4.5]decan-2-ylmethyl(2,2,2-trifluoroethyl)amino]ethanol
CID 102848142
2-[2,2-Difluoroethyl(1-oxaspiro[4.5]decan-2-ylmethyl)amino]ethanol
CID 107485738
2-(2-Cyclohexyl-3-methylmorpholino)ethanol
CID 45097980
6-Ethyl-3-[2-hydroxyethyl(methyl)amino]-2,4-dimethyloxan-4-ol
CID 67573367
2-[Cyclopentyl-[(4-methoxycyclohexyl)methyl]amino]ethanol
CID 138519686
2-(4-Cyclohexyl-2,2,3-trimethyl-1,3-oxazolidin-5-yl)ethanol
CID 150630007
[1-[2-(4-Ethyloxan-2-yl)ethyl]pyrrolidin-2-yl]methanol
CID 156242734
[1-[[Ethyl(oxolan-2-ylmethyl)amino]methyl]cyclohexyl]methanol
CID 55055183
2-[[Ethyl(oxolan-2-ylmethyl)amino]methyl]cyclohexan-1-ol
CID 55094912
5-Cyclohexyl-1-(2-ethoxyethyl)pyrrolidin-3-ol
CID 56790756
2-Cyclohexyl-2-(oxolan-2-ylmethylamino)ethanol
CID 61048167

Frequently Asked Questions

What is the IUPAC name of 2-[1-oxaspiro[4.5]decan-2-ylmethyl(propan-2-yl)amino]ethanol?
The IUPAC name of 2-[1-oxaspiro[4.5]decan-2-ylmethyl(propan-2-yl)amino]ethanol (CID 102848066) is 2-[1-oxaspiro[4.5]decan-2-ylmethyl(propan-2-yl)amino]ethanol.
What is the SMILES notation for 2-[1-oxaspiro[4.5]decan-2-ylmethyl(propan-2-yl)amino]ethanol?
The canonical SMILES for 2-[1-oxaspiro[4.5]decan-2-ylmethyl(propan-2-yl)amino]ethanol is CC(C)N(CCO)CC1CCC2(CCCCC2)O1.
What is the InChIKey of 2-[1-oxaspiro[4.5]decan-2-ylmethyl(propan-2-yl)amino]ethanol?
The InChIKey is VBRPCWXAJQNOPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO2/c1-13(2)16(10-11-17)12-14-6-9-15(18-14)7-4-3-5-8-15/h13-14,17H,3-12H2,1-2H3.
What are the key properties of 2-[1-oxaspiro[4.5]decan-2-ylmethyl(propan-2-yl)amino]ethanol?
2-[1-oxaspiro[4.5]decan-2-ylmethyl(propan-2-yl)amino]ethanol has a molecular weight of 255.40 g/mol, XLogP of 2.57, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-oxaspiro[4.5]decan-2-ylmethyl(propan-2-yl)amino]ethanol is sourced from PubChem (CID 102848066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).