2-[[cyclohexyl(2-hydroxyethyl)amino]methyl]-2-methylpentan-1-ol

C15H31NO2 — CID 62265116

IUPAC2-[[cyclohexyl(2-hydroxyethyl)amino]methyl]-2-methylpentan-1-ol
SMILESCCCC(C)(CO)CN(CCO)C1CCCCC1
InChIInChI=1S/C15H31NO2/c1-3-9-15(2,13-18)12-16(10-11-17)14-7-5-4-6-8-14/h14,17-18H,3-13H2,1-2H3
InChIKeySBMCZJXYRNDVLF-UHFFFAOYSA-N
MW257.42 g/mol
LogP2.41
Rot. Bonds8

About 2-[[cyclohexyl(2-hydroxyethyl)amino]methyl]-2-methylpentan-1-ol

2-[[cyclohexyl(2-hydroxyethyl)amino]methyl]-2-methylpentan-1-ol (PubChem CID 62265116) has the molecular formula C15H31NO2 and a molecular weight of 257.42 g/mol. Its IUPAC name is 2-[[cyclohexyl(2-hydroxyethyl)amino]methyl]-2-methylpentan-1-ol.

Molecular Properties

Compound Name2-[[cyclohexyl(2-hydroxyethyl)amino]methyl]-2-methylpentan-1-ol
PubChem CID62265116
Molecular FormulaC15H31NO2
Molecular Weight257.42 g/mol
Exact Mass257.24
IUPAC Name2-[[cyclohexyl(2-hydroxyethyl)amino]methyl]-2-methylpentan-1-ol
SMILESCCCC(C)(CO)CN(CCO)C1CCCCC1
InChIInChI=1S/C15H31NO2/c1-3-9-15(2,13-18)12-16(10-11-17)14-7-5-4-6-8-14/h14,17-18H,3-13H2,1-2H3
InChIKeySBMCZJXYRNDVLF-UHFFFAOYSA-N
XLogP2.41
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.42
LogP ≤ 52.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[cyclopropyl-[2-methyl-2-(methylaminomethyl)pentyl]amino]ethanol
CID 62270068
2-[cyclobutyl-[2-methyl-2-(methylaminomethyl)butyl]amino]ethanol
CID 102871030
2-[[cyclopentyl(2-hydroxyethyl)amino]methyl]-2-methylbutanal
CID 62275681
2-[cyclobutyl-[2-(ethylaminomethyl)-2-methylbutyl]amino]ethanol
CID 102870942
2-[cyclohexyl-[2,2-dimethyl-3-(propylamino)butyl]amino]ethanol
CID 66455597
2-[cyclohexyl(2-hydroxyethyl)amino]ethanol;nickel
CID 88833532
2-[[3-(tert-butylamino)-2,2-dimethylpropyl]-cyclohexylamino]ethanol
CID 62258926
2-[cyclopentyl-[3-(ethylamino)-2,2-dimethylpropyl]amino]ethanol
CID 62261165
2-[cyclobutyl(3,3-dimethylbutyl)amino]ethanol
CID 102676970
2-[cyclohexyl-[3-(ethylamino)-2,2-dimethylbutyl]amino]ethanol
CID 66452348
2-[cyclohexyl(2-ethylbutyl)amino]ethanol
CID 82930046
2-[[2-(aminomethyl)-2-ethylbutyl]-cyclopentylamino]ethanol
CID 62260812

Frequently Asked Questions

What is the IUPAC name of 2-[[cyclohexyl(2-hydroxyethyl)amino]methyl]-2-methylpentan-1-ol?
The IUPAC name of 2-[[cyclohexyl(2-hydroxyethyl)amino]methyl]-2-methylpentan-1-ol (CID 62265116) is 2-[[cyclohexyl(2-hydroxyethyl)amino]methyl]-2-methylpentan-1-ol.
What is the SMILES notation for 2-[[cyclohexyl(2-hydroxyethyl)amino]methyl]-2-methylpentan-1-ol?
The canonical SMILES for 2-[[cyclohexyl(2-hydroxyethyl)amino]methyl]-2-methylpentan-1-ol is CCCC(C)(CO)CN(CCO)C1CCCCC1.
What is the InChIKey of 2-[[cyclohexyl(2-hydroxyethyl)amino]methyl]-2-methylpentan-1-ol?
The InChIKey is SBMCZJXYRNDVLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31NO2/c1-3-9-15(2,13-18)12-16(10-11-17)14-7-5-4-6-8-14/h14,17-18H,3-13H2,1-2H3.
What are the key properties of 2-[[cyclohexyl(2-hydroxyethyl)amino]methyl]-2-methylpentan-1-ol?
2-[[cyclohexyl(2-hydroxyethyl)amino]methyl]-2-methylpentan-1-ol has a molecular weight of 257.42 g/mol, XLogP of 2.41, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[cyclohexyl(2-hydroxyethyl)amino]methyl]-2-methylpentan-1-ol is sourced from PubChem (CID 62265116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).