2-amino-2-methyl-3-(2-methylcyclohexyl)oxypropan-1-ol

C11H23NO2 — CID 64804233

IUPAC2-amino-2-methyl-3-(2-methylcyclohexyl)oxypropan-1-ol
SMILESCC1CCCCC1OCC(C)(N)CO
InChIInChI=1S/C11H23NO2/c1-9-5-3-4-6-10(9)14-8-11(2,12)7-13/h9-10,13H,3-8,12H2,1-2H3
InChIKeyXEBQWRQLQWDQHM-UHFFFAOYSA-N
MW201.31 g/mol
LogP1.29
Rot. Bonds4

About 2-amino-2-methyl-3-(2-methylcyclohexyl)oxypropan-1-ol

2-amino-2-methyl-3-(2-methylcyclohexyl)oxypropan-1-ol (PubChem CID 64804233) has the molecular formula C11H23NO2 and a molecular weight of 201.31 g/mol. Its IUPAC name is 2-amino-2-methyl-3-(2-methylcyclohexyl)oxypropan-1-ol.

Molecular Properties

Compound Name2-amino-2-methyl-3-(2-methylcyclohexyl)oxypropan-1-ol
PubChem CID64804233
Molecular FormulaC11H23NO2
Molecular Weight201.31 g/mol
Exact Mass201.17
IUPAC Name2-amino-2-methyl-3-(2-methylcyclohexyl)oxypropan-1-ol
SMILESCC1CCCCC1OCC(C)(N)CO
InChIInChI=1S/C11H23NO2/c1-9-5-3-4-6-10(9)14-8-11(2,12)7-13/h9-10,13H,3-8,12H2,1-2H3
InChIKeyXEBQWRQLQWDQHM-UHFFFAOYSA-N
XLogP1.29
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 51.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-amino-2-methyl-3-(2-methylcyclohexyl)oxypropan-1-ol?
The IUPAC name of 2-amino-2-methyl-3-(2-methylcyclohexyl)oxypropan-1-ol (CID 64804233) is 2-amino-2-methyl-3-(2-methylcyclohexyl)oxypropan-1-ol.
What is the SMILES notation for 2-amino-2-methyl-3-(2-methylcyclohexyl)oxypropan-1-ol?
The canonical SMILES for 2-amino-2-methyl-3-(2-methylcyclohexyl)oxypropan-1-ol is CC1CCCCC1OCC(C)(N)CO.
What is the InChIKey of 2-amino-2-methyl-3-(2-methylcyclohexyl)oxypropan-1-ol?
The InChIKey is XEBQWRQLQWDQHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO2/c1-9-5-3-4-6-10(9)14-8-11(2,12)7-13/h9-10,13H,3-8,12H2,1-2H3.
What are the key properties of 2-amino-2-methyl-3-(2-methylcyclohexyl)oxypropan-1-ol?
2-amino-2-methyl-3-(2-methylcyclohexyl)oxypropan-1-ol has a molecular weight of 201.31 g/mol, XLogP of 1.29, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-methyl-3-(2-methylcyclohexyl)oxypropan-1-ol is sourced from PubChem (CID 64804233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).