6-azidohexan-1-ol

C6H13N3O — CID 11051778

IUPAC6-azidohexan-1-ol
SMILES[N-]=[N+]=NCCCCCCO
InChIInChI=1S/C6H13N3O/c7-9-8-5-3-1-2-4-6-10/h10H,1-6H2
InChIKeyWHYHCPIPOSTZRU-UHFFFAOYSA-N
MW143.19 g/mol
LogP1.85
Rot. Bonds6

About 6-azidohexan-1-ol

6-azidohexan-1-ol (PubChem CID 11051778) has the molecular formula C6H13N3O and a molecular weight of 143.19 g/mol. Its IUPAC name is 6-azidohexan-1-ol.

Molecular Properties

Compound Name6-azidohexan-1-ol
PubChem CID11051778
Molecular FormulaC6H13N3O
Molecular Weight143.19 g/mol
Exact Mass143.11
IUPAC Name6-azidohexan-1-ol
SMILES[N-]=[N+]=NCCCCCCO
InChIInChI=1S/C6H13N3O/c7-9-8-5-3-1-2-4-6-10/h10H,1-6H2
InChIKeyWHYHCPIPOSTZRU-UHFFFAOYSA-N
XLogP1.85
TPSA68.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.19
LogP ≤ 51.85
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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Related Compounds

10-azidodecan-1-ol
CID 4641376
8-azidooctan-1-ol
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6-azidohexan-1-ol;6-bromohexan-1-ol
CID 159972484
3-azidopropan-1-ol
CID 10996974
1,14-diazidotetradecane
CID 146463967
6-azido-1,1-dideuteriohexan-1-ol
CID 175904391
[2,3,4,5,6-pentakis(11-azidoundecanoyloxy)cyclohexyl] 11-azidoundecanoate
CID 102393083
9-azidononane-1-thiol
CID 89455155
9-azidononan-1-amine
CID 122424851
1-azidotriacontane
CID 71752669
CID 167612396
CID 167612396
9-azidononanoic acid
CID 15230549

Frequently Asked Questions

What is the IUPAC name of 6-azidohexan-1-ol?
The IUPAC name of 6-azidohexan-1-ol (CID 11051778) is 6-azidohexan-1-ol.
What is the SMILES notation for 6-azidohexan-1-ol?
The canonical SMILES for 6-azidohexan-1-ol is [N-]=[N+]=NCCCCCCO.
What is the InChIKey of 6-azidohexan-1-ol?
The InChIKey is WHYHCPIPOSTZRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13N3O/c7-9-8-5-3-1-2-4-6-10/h10H,1-6H2.
What are the key properties of 6-azidohexan-1-ol?
6-azidohexan-1-ol has a molecular weight of 143.19 g/mol, XLogP of 1.85, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-azidohexan-1-ol is sourced from PubChem (CID 11051778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).