2-[2-hydroxyethyl(methyl)amino]cyclohexan-1-ol

C9H19NO2 — CID 60714720

IUPAC2-[2-hydroxyethyl(methyl)amino]cyclohexan-1-ol
SMILESCN(CCO)C1CCCCC1O
InChIInChI=1S/C9H19NO2/c1-10(6-7-11)8-4-2-3-5-9(8)12/h8-9,11-12H,2-7H2,1H3
InChIKeyKPUSMNAYGYVMRO-UHFFFAOYSA-N
MW173.26 g/mol
LogP0.21
Rot. Bonds3

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

2-[2-hydroxyethyl(methyl)amino]cyclohexan-1-ol (PubChem CID 60714720) has the molecular formula C9H19NO2 and a molecular weight of 173.26 g/mol. Its IUPAC name is 2-[2-hydroxyethyl(methyl)amino]cyclohexan-1-ol.

Molecular Properties

Compound Name2-[2-hydroxyethyl(methyl)amino]cyclohexan-1-ol
PubChem CID60714720
Molecular FormulaC9H19NO2
Molecular Weight173.26 g/mol
Exact Mass173.14
IUPAC Name2-[2-hydroxyethyl(methyl)amino]cyclohexan-1-ol
SMILESCN(CCO)C1CCCCC1O
InChIInChI=1S/C9H19NO2/c1-10(6-7-11)8-4-2-3-5-9(8)12/h8-9,11-12H,2-7H2,1H3
InChIKeyKPUSMNAYGYVMRO-UHFFFAOYSA-N
XLogP0.21
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 50.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[2-hydroxyethyl(methyl)amino]cyclohexan-1-ol?
The IUPAC name of 2-[2-hydroxyethyl(methyl)amino]cyclohexan-1-ol (CID 60714720) is 2-[2-hydroxyethyl(methyl)amino]cyclohexan-1-ol.
What is the SMILES notation for 2-[2-hydroxyethyl(methyl)amino]cyclohexan-1-ol?
The canonical SMILES for 2-[2-hydroxyethyl(methyl)amino]cyclohexan-1-ol is CN(CCO)C1CCCCC1O.
What is the InChIKey of 2-[2-hydroxyethyl(methyl)amino]cyclohexan-1-ol?
The InChIKey is KPUSMNAYGYVMRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO2/c1-10(6-7-11)8-4-2-3-5-9(8)12/h8-9,11-12H,2-7H2,1H3.
What are the key properties of 2-[2-hydroxyethyl(methyl)amino]cyclohexan-1-ol?
2-[2-hydroxyethyl(methyl)amino]cyclohexan-1-ol has a molecular weight of 173.26 g/mol, XLogP of 0.21, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-hydroxyethyl(methyl)amino]cyclohexan-1-ol is sourced from PubChem (CID 60714720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).