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

C11H21NO2 — CID 63298849

IUPAC2-[(2-cyclopropyl-2-hydroxyethyl)amino]cyclohexan-1-ol
SMILESOC(CNC1CCCCC1O)C1CC1
InChIInChI=1S/C11H21NO2/c13-10-4-2-1-3-9(10)12-7-11(14)8-5-6-8/h8-14H,1-7H2
InChIKeyUJTBTJRRDHHONQ-UHFFFAOYSA-N
MW199.29 g/mol
LogP0.65
Rot. Bonds4

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

2-[(2-cyclopropyl-2-hydroxyethyl)amino]cyclohexan-1-ol (PubChem CID 63298849) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is 2-[(2-cyclopropyl-2-hydroxyethyl)amino]cyclohexan-1-ol.

Molecular Properties

Compound Name2-[(2-cyclopropyl-2-hydroxyethyl)amino]cyclohexan-1-ol
PubChem CID63298849
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC Name2-[(2-cyclopropyl-2-hydroxyethyl)amino]cyclohexan-1-ol
SMILESOC(CNC1CCCCC1O)C1CC1
InChIInChI=1S/C11H21NO2/c13-10-4-2-1-3-9(10)12-7-11(14)8-5-6-8/h8-14H,1-7H2
InChIKeyUJTBTJRRDHHONQ-UHFFFAOYSA-N
XLogP0.65
TPSA52.49 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 50.65
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(2-cyclopropyl-2-hydroxyethyl)amino]cyclohexan-1-ol?
The IUPAC name of 2-[(2-cyclopropyl-2-hydroxyethyl)amino]cyclohexan-1-ol (CID 63298849) is 2-[(2-cyclopropyl-2-hydroxyethyl)amino]cyclohexan-1-ol.
What is the SMILES notation for 2-[(2-cyclopropyl-2-hydroxyethyl)amino]cyclohexan-1-ol?
The canonical SMILES for 2-[(2-cyclopropyl-2-hydroxyethyl)amino]cyclohexan-1-ol is OC(CNC1CCCCC1O)C1CC1.
What is the InChIKey of 2-[(2-cyclopropyl-2-hydroxyethyl)amino]cyclohexan-1-ol?
The InChIKey is UJTBTJRRDHHONQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO2/c13-10-4-2-1-3-9(10)12-7-11(14)8-5-6-8/h8-14H,1-7H2.
What are the key properties of 2-[(2-cyclopropyl-2-hydroxyethyl)amino]cyclohexan-1-ol?
2-[(2-cyclopropyl-2-hydroxyethyl)amino]cyclohexan-1-ol has a molecular weight of 199.29 g/mol, XLogP of 0.65, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-cyclopropyl-2-hydroxyethyl)amino]cyclohexan-1-ol is sourced from PubChem (CID 63298849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).