(2R)-5-amino-2-ethyloct-7-en-1-ol

C10H21NO — CID 146259970

IUPAC(2R)-5-amino-2-ethyloct-7-en-1-ol
SMILESC=CCC(N)CC[C@@H](CC)CO
InChIInChI=1S/C10H21NO/c1-3-5-10(11)7-6-9(4-2)8-12/h3,9-10,12H,1,4-8,11H2,2H3/t9-,10?/m1/s1
InChIKeyRIYHAFOPAQSZIT-YHMJZVADSA-N
MW171.28 g/mol
LogP1.69
Rot. Bonds7

About (2R)-5-amino-2-ethyloct-7-en-1-ol

(2R)-5-amino-2-ethyloct-7-en-1-ol (PubChem CID 146259970) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is (2R)-5-amino-2-ethyloct-7-en-1-ol.

Molecular Properties

Compound Name(2R)-5-amino-2-ethyloct-7-en-1-ol
PubChem CID146259970
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Name(2R)-5-amino-2-ethyloct-7-en-1-ol
SMILESC=CCC(N)CC[C@@H](CC)CO
InChIInChI=1S/C10H21NO/c1-3-5-10(11)7-6-9(4-2)8-12/h3,9-10,12H,1,4-8,11H2,2H3/t9-,10?/m1/s1
InChIKeyRIYHAFOPAQSZIT-YHMJZVADSA-N
XLogP1.69
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 51.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (2R)-5-amino-2-ethyloct-7-en-1-ol?
The IUPAC name of (2R)-5-amino-2-ethyloct-7-en-1-ol (CID 146259970) is (2R)-5-amino-2-ethyloct-7-en-1-ol.
What is the SMILES notation for (2R)-5-amino-2-ethyloct-7-en-1-ol?
The canonical SMILES for (2R)-5-amino-2-ethyloct-7-en-1-ol is C=CCC(N)CC[C@@H](CC)CO.
What is the InChIKey of (2R)-5-amino-2-ethyloct-7-en-1-ol?
The InChIKey is RIYHAFOPAQSZIT-YHMJZVADSA-N. The full InChI is InChI=1S/C10H21NO/c1-3-5-10(11)7-6-9(4-2)8-12/h3,9-10,12H,1,4-8,11H2,2H3/t9-,10?/m1/s1.
What are the key properties of (2R)-5-amino-2-ethyloct-7-en-1-ol?
(2R)-5-amino-2-ethyloct-7-en-1-ol has a molecular weight of 171.28 g/mol, XLogP of 1.69, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-5-amino-2-ethyloct-7-en-1-ol is sourced from PubChem (CID 146259970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).