2-[2-hydroxyethyl-(4-methylcyclohexyl)amino]ethanol

C11H23NO2 — CID 30982289

IUPAC2-[2-hydroxyethyl-(4-methylcyclohexyl)amino]ethanol
SMILESCC1CCC(N(CCO)CCO)CC1
InChIInChI=1S/C11H23NO2/c1-10-2-4-11(5-3-10)12(6-8-13)7-9-14/h10-11,13-14H,2-9H2,1H3
InChIKeyVGTFZHWHKZOKKQ-UHFFFAOYSA-N
MW201.31 g/mol
LogP0.85
Rot. Bonds5

About 2-[2-hydroxyethyl-(4-methylcyclohexyl)amino]ethanol

2-[2-hydroxyethyl-(4-methylcyclohexyl)amino]ethanol (PubChem CID 30982289) has the molecular formula C11H23NO2 and a molecular weight of 201.31 g/mol. Its IUPAC name is 2-[2-hydroxyethyl-(4-methylcyclohexyl)amino]ethanol.

Molecular Properties

Compound Name2-[2-hydroxyethyl-(4-methylcyclohexyl)amino]ethanol
PubChem CID30982289
Molecular FormulaC11H23NO2
Molecular Weight201.31 g/mol
Exact Mass201.17
IUPAC Name2-[2-hydroxyethyl-(4-methylcyclohexyl)amino]ethanol
SMILESCC1CCC(N(CCO)CCO)CC1
InChIInChI=1S/C11H23NO2/c1-10-2-4-11(5-3-10)12(6-8-13)7-9-14/h10-11,13-14H,2-9H2,1H3
InChIKeyVGTFZHWHKZOKKQ-UHFFFAOYSA-N
XLogP0.85
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 50.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[2-hydroxyethyl-(4-methylcyclohexyl)amino]ethanol?
The IUPAC name of 2-[2-hydroxyethyl-(4-methylcyclohexyl)amino]ethanol (CID 30982289) is 2-[2-hydroxyethyl-(4-methylcyclohexyl)amino]ethanol.
What is the SMILES notation for 2-[2-hydroxyethyl-(4-methylcyclohexyl)amino]ethanol?
The canonical SMILES for 2-[2-hydroxyethyl-(4-methylcyclohexyl)amino]ethanol is CC1CCC(N(CCO)CCO)CC1.
What is the InChIKey of 2-[2-hydroxyethyl-(4-methylcyclohexyl)amino]ethanol?
The InChIKey is VGTFZHWHKZOKKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO2/c1-10-2-4-11(5-3-10)12(6-8-13)7-9-14/h10-11,13-14H,2-9H2,1H3.
What are the key properties of 2-[2-hydroxyethyl-(4-methylcyclohexyl)amino]ethanol?
2-[2-hydroxyethyl-(4-methylcyclohexyl)amino]ethanol has a molecular weight of 201.31 g/mol, XLogP of 0.85, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-hydroxyethyl-(4-methylcyclohexyl)amino]ethanol is sourced from PubChem (CID 30982289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).