2-amino-1-cyclooctylethanol

C10H21NO — CID 1551

IUPAC2-amino-1-cyclooctylethanol
SMILESNCC(O)C1CCCCCCC1
InChIInChI=1S/C10H21NO/c11-8-10(12)9-6-4-2-1-3-5-7-9/h9-10,12H,1-8,11H2
InChIKeyNUOYMOJXFODLFN-UHFFFAOYSA-N
MW171.28 g/mol
LogP1.67
Rot. Bonds2

About 2-amino-1-cyclooctylethanol

2-amino-1-cyclooctylethanol (PubChem CID 1551) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is 2-amino-1-cyclooctylethanol.

Molecular Properties

Compound Name2-amino-1-cyclooctylethanol
PubChem CID1551
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Name2-amino-1-cyclooctylethanol
SMILESNCC(O)C1CCCCCCC1
InChIInChI=1S/C10H21NO/c11-8-10(12)9-6-4-2-1-3-5-7-9/h9-10,12H,1-8,11H2
InChIKeyNUOYMOJXFODLFN-UHFFFAOYSA-N
XLogP1.67
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-amino-1-cyclooctylethanol?
The IUPAC name of 2-amino-1-cyclooctylethanol (CID 1551) is 2-amino-1-cyclooctylethanol.
What is the SMILES notation for 2-amino-1-cyclooctylethanol?
The canonical SMILES for 2-amino-1-cyclooctylethanol is NCC(O)C1CCCCCCC1.
What is the InChIKey of 2-amino-1-cyclooctylethanol?
The InChIKey is NUOYMOJXFODLFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO/c11-8-10(12)9-6-4-2-1-3-5-7-9/h9-10,12H,1-8,11H2.
What are the key properties of 2-amino-1-cyclooctylethanol?
2-amino-1-cyclooctylethanol has a molecular weight of 171.28 g/mol, XLogP of 1.67, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-cyclooctylethanol is sourced from PubChem (CID 1551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).