2-[methyl(1-oxaspiro[4.5]decan-2-ylmethyl)amino]propan-1-ol

C14H27NO2 — CID 102848139

IUPAC2-[methyl(1-oxaspiro[4.5]decan-2-ylmethyl)amino]propan-1-ol
SMILESCC(CO)N(C)CC1CCC2(CCCCC2)O1
InChIInChI=1S/C14H27NO2/c1-12(11-16)15(2)10-13-6-9-14(17-13)7-4-3-5-8-14/h12-13,16H,3-11H2,1-2H3
InChIKeyDQJWDLYOFQTMCO-UHFFFAOYSA-N
MW241.37 g/mol
LogP2.18
Rot. Bonds4

About 2-[methyl(1-oxaspiro[4.5]decan-2-ylmethyl)amino]propan-1-ol

2-[methyl(1-oxaspiro[4.5]decan-2-ylmethyl)amino]propan-1-ol (PubChem CID 102848139) has the molecular formula C14H27NO2 and a molecular weight of 241.37 g/mol. Its IUPAC name is 2-[methyl(1-oxaspiro[4.5]decan-2-ylmethyl)amino]propan-1-ol.

Molecular Properties

Compound Name2-[methyl(1-oxaspiro[4.5]decan-2-ylmethyl)amino]propan-1-ol
PubChem CID102848139
Molecular FormulaC14H27NO2
Molecular Weight241.37 g/mol
Exact Mass241.20
IUPAC Name2-[methyl(1-oxaspiro[4.5]decan-2-ylmethyl)amino]propan-1-ol
SMILESCC(CO)N(C)CC1CCC2(CCCCC2)O1
InChIInChI=1S/C14H27NO2/c1-12(11-16)15(2)10-13-6-9-14(17-13)7-4-3-5-8-14/h12-13,16H,3-11H2,1-2H3
InChIKeyDQJWDLYOFQTMCO-UHFFFAOYSA-N
XLogP2.18
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.37
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[methyl(1-oxaspiro[4.5]decan-2-ylmethyl)amino]propan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

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
1-({[(3R,4S)-4-fluorooxolan-3-yl](methyl)amino}methyl)cyclohexan-1-ol
CID 168021409
4-Cyclohexyl-3-morpholin-4-ylbutan-2-ol
CID 57140107
(2R)-1-[(2S)-4-methoxy-1-methylpyrrolidin-2-yl]-2-methylbutan-1-ol
CID 59953233
6-Ethyl-3-[2-hydroxyethyl(methyl)amino]-2,4-dimethyloxan-4-ol
CID 67573367
3-[[5-(Methoxymethyl)-1-methylpyrrolidin-3-yl]methyl]cyclobutan-1-ol
CID 138569426
[1-[2-[4-(Cyclohexylmethyl)cyclohexyl]oxyethyl]pyrrolidin-2-yl]methanol
CID 140449940
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-(4-Methoxy-1-methylpyrrolidin-2-yl)-2-methylbutan-1-ol
CID 20647905

Frequently Asked Questions

What is the IUPAC name of 2-[methyl(1-oxaspiro[4.5]decan-2-ylmethyl)amino]propan-1-ol?
The IUPAC name of 2-[methyl(1-oxaspiro[4.5]decan-2-ylmethyl)amino]propan-1-ol (CID 102848139) is 2-[methyl(1-oxaspiro[4.5]decan-2-ylmethyl)amino]propan-1-ol.
What is the SMILES notation for 2-[methyl(1-oxaspiro[4.5]decan-2-ylmethyl)amino]propan-1-ol?
The canonical SMILES for 2-[methyl(1-oxaspiro[4.5]decan-2-ylmethyl)amino]propan-1-ol is CC(CO)N(C)CC1CCC2(CCCCC2)O1.
What is the InChIKey of 2-[methyl(1-oxaspiro[4.5]decan-2-ylmethyl)amino]propan-1-ol?
The InChIKey is DQJWDLYOFQTMCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO2/c1-12(11-16)15(2)10-13-6-9-14(17-13)7-4-3-5-8-14/h12-13,16H,3-11H2,1-2H3.
What are the key properties of 2-[methyl(1-oxaspiro[4.5]decan-2-ylmethyl)amino]propan-1-ol?
2-[methyl(1-oxaspiro[4.5]decan-2-ylmethyl)amino]propan-1-ol has a molecular weight of 241.37 g/mol, XLogP of 2.18, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl(1-oxaspiro[4.5]decan-2-ylmethyl)amino]propan-1-ol is sourced from PubChem (CID 102848139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).