3-morpholin-4-yloct-7-en-1-amine

C12H24N2O — CID 70245026

IUPAC3-morpholin-4-yloct-7-en-1-amine
SMILESC=CCCCC(CCN)N1CCOCC1
InChIInChI=1S/C12H24N2O/c1-2-3-4-5-12(6-7-13)14-8-10-15-11-9-14/h2,12H,1,3-11,13H2
InChIKeyIZNGJBADDYRUQZ-UHFFFAOYSA-N
MW212.34 g/mol
LogP1.39
Rot. Bonds7

About 3-morpholin-4-yloct-7-en-1-amine

3-morpholin-4-yloct-7-en-1-amine (PubChem CID 70245026) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is 3-morpholin-4-yloct-7-en-1-amine.

Molecular Properties

Compound Name3-morpholin-4-yloct-7-en-1-amine
PubChem CID70245026
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC Name3-morpholin-4-yloct-7-en-1-amine
SMILESC=CCCCC(CCN)N1CCOCC1
InChIInChI=1S/C12H24N2O/c1-2-3-4-5-12(6-7-13)14-8-10-15-11-9-14/h2,12H,1,3-11,13H2
InChIKeyIZNGJBADDYRUQZ-UHFFFAOYSA-N
XLogP1.39
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-morpholin-4-yloct-7-en-1-amine?
The IUPAC name of 3-morpholin-4-yloct-7-en-1-amine (CID 70245026) is 3-morpholin-4-yloct-7-en-1-amine.
What is the SMILES notation for 3-morpholin-4-yloct-7-en-1-amine?
The canonical SMILES for 3-morpholin-4-yloct-7-en-1-amine is C=CCCCC(CCN)N1CCOCC1.
What is the InChIKey of 3-morpholin-4-yloct-7-en-1-amine?
The InChIKey is IZNGJBADDYRUQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c1-2-3-4-5-12(6-7-13)14-8-10-15-11-9-14/h2,12H,1,3-11,13H2.
What are the key properties of 3-morpholin-4-yloct-7-en-1-amine?
3-morpholin-4-yloct-7-en-1-amine has a molecular weight of 212.34 g/mol, XLogP of 1.39, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-morpholin-4-yloct-7-en-1-amine is sourced from PubChem (CID 70245026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).