8-aminoundec-10-en-1-ol

C11H23NO — CID 134550869

IUPAC8-aminoundec-10-en-1-ol
SMILESC=CCC(N)CCCCCCCO
InChIInChI=1S/C11H23NO/c1-2-8-11(12)9-6-4-3-5-7-10-13/h2,11,13H,1,3-10,12H2
InChIKeyHPCRKVWAAHBYAV-UHFFFAOYSA-N
MW185.31 g/mol
LogP2.22
Rot. Bonds9

About 8-aminoundec-10-en-1-ol

8-aminoundec-10-en-1-ol (PubChem CID 134550869) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is 8-aminoundec-10-en-1-ol.

Molecular Properties

Compound Name8-aminoundec-10-en-1-ol
PubChem CID134550869
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC Name8-aminoundec-10-en-1-ol
SMILESC=CCC(N)CCCCCCCO
InChIInChI=1S/C11H23NO/c1-2-8-11(12)9-6-4-3-5-7-10-13/h2,11,13H,1,3-10,12H2
InChIKeyHPCRKVWAAHBYAV-UHFFFAOYSA-N
XLogP2.22
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 52.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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 8-aminoundec-10-en-1-ol?
The IUPAC name of 8-aminoundec-10-en-1-ol (CID 134550869) is 8-aminoundec-10-en-1-ol.
What is the SMILES notation for 8-aminoundec-10-en-1-ol?
The canonical SMILES for 8-aminoundec-10-en-1-ol is C=CCC(N)CCCCCCCO.
What is the InChIKey of 8-aminoundec-10-en-1-ol?
The InChIKey is HPCRKVWAAHBYAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-2-8-11(12)9-6-4-3-5-7-10-13/h2,11,13H,1,3-10,12H2.
What are the key properties of 8-aminoundec-10-en-1-ol?
8-aminoundec-10-en-1-ol has a molecular weight of 185.31 g/mol, XLogP of 2.22, 9 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-aminoundec-10-en-1-ol is sourced from PubChem (CID 134550869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).