2-[2-adamantyl(methyl)amino]ethanol

C13H23NO — CID 175776564

IUPAC2-[2-adamantyl(methyl)amino]ethanol
SMILESCN(CCO)C1C2CC3CC(C2)CC1C3
InChIInChI=1S/C13H23NO/c1-14(2-3-15)13-11-5-9-4-10(7-11)8-12(13)6-9/h9-13,15H,2-8H2,1H3
InChIKeyOZKSCFQXFSLRMG-UHFFFAOYSA-N
MW209.33 g/mol
LogP1.74
Rot. Bonds3

About 2-[2-adamantyl(methyl)amino]ethanol

2-[2-adamantyl(methyl)amino]ethanol (PubChem CID 175776564) has the molecular formula C13H23NO and a molecular weight of 209.33 g/mol. Its IUPAC name is 2-[2-adamantyl(methyl)amino]ethanol.

Molecular Properties

Compound Name2-[2-adamantyl(methyl)amino]ethanol
PubChem CID175776564
Molecular FormulaC13H23NO
Molecular Weight209.33 g/mol
Exact Mass209.18
IUPAC Name2-[2-adamantyl(methyl)amino]ethanol
SMILESCN(CCO)C1C2CC3CC(C2)CC1C3
InChIInChI=1S/C13H23NO/c1-14(2-3-15)13-11-5-9-4-10(7-11)8-12(13)6-9/h9-13,15H,2-8H2,1H3
InChIKeyOZKSCFQXFSLRMG-UHFFFAOYSA-N
XLogP1.74
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.33
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Ethanol, 2,2'-(tricyclo(3.3.1.13,7)dec-1-ylimino)bis-
CID 64156
Ethanol, 2-(2-adamantylamino)-, hydrochloride
CID 64368
2-(2-Adamantylamino)ethanol
CID 64369
2-[1-Adamantyl(methyl)amino]ethanol
CID 2848038
2-[4-(2-Adamantyl)-1-piperazinyl]ethanol
CID 2846644
Adamantane, 1-(2-(N-(2-hydroxyethyl)-N-methyl)aminopropyl)-, hydrochloride
CID 36009
Ethanol, 2,2'-(1-adamantylimino)di-, hydrochloride
CID 64190
[1-(2-Adamantyl)-2-pyrrolidinyl]methanol
CID 2845433
2-[Di-(2-hydroxyethyl)amino]adamantane
CID 13708601
[N-methyl-N-(1-adamantyl)amino]ethanol
CID 129778711
2-[1-(1-Adamantyl)propan-2-yl-methylamino]ethanol
CID 36010
1-[1-Adamantyl(2-hydroxypropyl)amino]propan-2-ol
CID 64192

Frequently Asked Questions

What is the IUPAC name of 2-[2-adamantyl(methyl)amino]ethanol?
The IUPAC name of 2-[2-adamantyl(methyl)amino]ethanol (CID 175776564) is 2-[2-adamantyl(methyl)amino]ethanol.
What is the SMILES notation for 2-[2-adamantyl(methyl)amino]ethanol?
The canonical SMILES for 2-[2-adamantyl(methyl)amino]ethanol is CN(CCO)C1C2CC3CC(C2)CC1C3.
What is the InChIKey of 2-[2-adamantyl(methyl)amino]ethanol?
The InChIKey is OZKSCFQXFSLRMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NO/c1-14(2-3-15)13-11-5-9-4-10(7-11)8-12(13)6-9/h9-13,15H,2-8H2,1H3.
What are the key properties of 2-[2-adamantyl(methyl)amino]ethanol?
2-[2-adamantyl(methyl)amino]ethanol has a molecular weight of 209.33 g/mol, XLogP of 1.74, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-adamantyl(methyl)amino]ethanol is sourced from PubChem (CID 175776564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).