5-(3-azidoprop-1-enyl)pyridin-3-ol

C8H8N4O — CID 169461299

IUPAC5-(3-azidoprop-1-enyl)pyridin-3-ol
SMILES[N-]=[N+]=NCC=Cc1cncc(O)c1
InChIInChI=1S/C8H8N4O/c9-12-11-3-1-2-7-4-8(13)6-10-5-7/h1-2,4-6,13H,3H2
InChIKeyZFEQUQWIQZWMSN-UHFFFAOYSA-N
MW176.18 g/mol
LogP2.11
Rot. Bonds3

About 5-(3-azidoprop-1-enyl)pyridin-3-ol

5-(3-azidoprop-1-enyl)pyridin-3-ol (PubChem CID 169461299) has the molecular formula C8H8N4O and a molecular weight of 176.18 g/mol. Its IUPAC name is 5-(3-azidoprop-1-enyl)pyridin-3-ol.

Molecular Properties

Compound Name5-(3-azidoprop-1-enyl)pyridin-3-ol
PubChem CID169461299
Molecular FormulaC8H8N4O
Molecular Weight176.18 g/mol
Exact Mass176.07
IUPAC Name5-(3-azidoprop-1-enyl)pyridin-3-ol
SMILES[N-]=[N+]=NCC=Cc1cncc(O)c1
InChIInChI=1S/C8H8N4O/c9-12-11-3-1-2-7-4-8(13)6-10-5-7/h1-2,4-6,13H,3H2
InChIKeyZFEQUQWIQZWMSN-UHFFFAOYSA-N
XLogP2.11
TPSA81.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.18
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', '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

5-(3-bromoprop-1-enyl)pyridin-3-ol
CID 169475014
4-(3-azidoprop-1-enyl)-2,6-dibromophenol
CID 169462874
5-(3-azidoprop-1-enyl)-2-methylpyridin-3-amine
CID 169461419
6-(3-azidoprop-1-enyl)pyridin-3-ol
CID 169461303
6-(3-azidoprop-1-enyl)-1H-pyrazolo[4,5-b]pyridine
CID 169461887
[5-(3-azidoprop-1-enyl)-2-pyridinyl]methanol
CID 169461523
5-(3-azidoprop-1-enyl)-2-fluoropyridine
CID 169461269
5-(4-azidobut-1-enyl)pyridine-3-carboxamide
CID 170485248
4-(3-azidoprop-1-enyl)benzene-1,2-diamine
CID 169461436
1-(3-azidoprop-1-enyl)-4-(methoxymethyl)benzene
CID 169461658
5-(3-azidoprop-1-enyl)-3-nitropyridin-2-amine
CID 169462186
1-(3-azidoprop-1-enyl)-4-chlorobenzene
CID 141280694

Frequently Asked Questions

What is the IUPAC name of 5-(3-azidoprop-1-enyl)pyridin-3-ol?
The IUPAC name of 5-(3-azidoprop-1-enyl)pyridin-3-ol (CID 169461299) is 5-(3-azidoprop-1-enyl)pyridin-3-ol.
What is the SMILES notation for 5-(3-azidoprop-1-enyl)pyridin-3-ol?
The canonical SMILES for 5-(3-azidoprop-1-enyl)pyridin-3-ol is [N-]=[N+]=NCC=Cc1cncc(O)c1.
What is the InChIKey of 5-(3-azidoprop-1-enyl)pyridin-3-ol?
The InChIKey is ZFEQUQWIQZWMSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N4O/c9-12-11-3-1-2-7-4-8(13)6-10-5-7/h1-2,4-6,13H,3H2.
What are the key properties of 5-(3-azidoprop-1-enyl)pyridin-3-ol?
5-(3-azidoprop-1-enyl)pyridin-3-ol has a molecular weight of 176.18 g/mol, XLogP of 2.11, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-azidoprop-1-enyl)pyridin-3-ol is sourced from PubChem (CID 169461299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).