(2R,5Z)-2-aminoocta-5,7-dien-1-ol

C8H15NO — CID 118669999

IUPAC(2R,5Z)-2-aminoocta-5,7-dien-1-ol
SMILESC=C/C=C\CC[C@@H](N)CO
InChIInChI=1S/C8H15NO/c1-2-3-4-5-6-8(9)7-10/h2-4,8,10H,1,5-7,9H2/b4-3-/t8-/m1/s1
InChIKeyUNUVNJONLBDJCH-TUUFMJSCSA-N
MW141.21 g/mol
LogP0.83
Rot. Bonds5

About (2R,5Z)-2-aminoocta-5,7-dien-1-ol

(2R,5Z)-2-aminoocta-5,7-dien-1-ol (PubChem CID 118669999) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is (2R,5Z)-2-aminoocta-5,7-dien-1-ol.

Molecular Properties

Compound Name(2R,5Z)-2-aminoocta-5,7-dien-1-ol
PubChem CID118669999
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC Name(2R,5Z)-2-aminoocta-5,7-dien-1-ol
SMILESC=C/C=C\CC[C@@H](N)CO
InChIInChI=1S/C8H15NO/c1-2-3-4-5-6-8(9)7-10/h2-4,8,10H,1,5-7,9H2/b4-3-/t8-/m1/s1
InChIKeyUNUVNJONLBDJCH-TUUFMJSCSA-N
XLogP0.83
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 50.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (2R,5Z)-2-aminoocta-5,7-dien-1-ol?
The IUPAC name of (2R,5Z)-2-aminoocta-5,7-dien-1-ol (CID 118669999) is (2R,5Z)-2-aminoocta-5,7-dien-1-ol.
What is the SMILES notation for (2R,5Z)-2-aminoocta-5,7-dien-1-ol?
The canonical SMILES for (2R,5Z)-2-aminoocta-5,7-dien-1-ol is C=C/C=C\CC[C@@H](N)CO.
What is the InChIKey of (2R,5Z)-2-aminoocta-5,7-dien-1-ol?
The InChIKey is UNUVNJONLBDJCH-TUUFMJSCSA-N. The full InChI is InChI=1S/C8H15NO/c1-2-3-4-5-6-8(9)7-10/h2-4,8,10H,1,5-7,9H2/b4-3-/t8-/m1/s1.
What are the key properties of (2R,5Z)-2-aminoocta-5,7-dien-1-ol?
(2R,5Z)-2-aminoocta-5,7-dien-1-ol has a molecular weight of 141.21 g/mol, XLogP of 0.83, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,5Z)-2-aminoocta-5,7-dien-1-ol is sourced from PubChem (CID 118669999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).