10-azidodecan-1-ol

C10H21N3O — CID 4641376

IUPAC10-azidodecan-1-ol
SMILES[N-]=[N+]=NCCCCCCCCCCO
InChIInChI=1S/C10H21N3O/c11-13-12-9-7-5-3-1-2-4-6-8-10-14/h14H,1-10H2
InChIKeyVSOCJQSZRBCJET-UHFFFAOYSA-N
MW199.30 g/mol
LogP3.41
Rot. Bonds10

About 10-azidodecan-1-ol

10-azidodecan-1-ol (PubChem CID 4641376) has the molecular formula C10H21N3O and a molecular weight of 199.30 g/mol. Its IUPAC name is 10-azidodecan-1-ol.

Molecular Properties

Compound Name10-azidodecan-1-ol
PubChem CID4641376
Molecular FormulaC10H21N3O
Molecular Weight199.30 g/mol
Exact Mass199.17
IUPAC Name10-azidodecan-1-ol
SMILES[N-]=[N+]=NCCCCCCCCCCO
InChIInChI=1S/C10H21N3O/c11-13-12-9-7-5-3-1-2-4-6-8-10-14/h14H,1-10H2
InChIKeyVSOCJQSZRBCJET-UHFFFAOYSA-N
XLogP3.41
TPSA68.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.30
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_3', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 10-azidodecan-1-ol?
The IUPAC name of 10-azidodecan-1-ol (CID 4641376) is 10-azidodecan-1-ol.
What is the SMILES notation for 10-azidodecan-1-ol?
The canonical SMILES for 10-azidodecan-1-ol is [N-]=[N+]=NCCCCCCCCCCO.
What is the InChIKey of 10-azidodecan-1-ol?
The InChIKey is VSOCJQSZRBCJET-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O/c11-13-12-9-7-5-3-1-2-4-6-8-10-14/h14H,1-10H2.
What are the key properties of 10-azidodecan-1-ol?
10-azidodecan-1-ol has a molecular weight of 199.30 g/mol, XLogP of 3.41, 10 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10-azidodecan-1-ol is sourced from PubChem (CID 4641376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).