4-(2-azidoethoxy)pyridin-2-amine

C7H9N5O — CID 169237712

IUPAC4-(2-azidoethoxy)pyridin-2-amine
SMILES[N-]=[N+]=NCCOc1ccnc(N)c1
InChIInChI=1S/C7H9N5O/c8-7-5-6(1-2-10-7)13-4-3-11-12-9/h1-2,5H,3-4H2,(H2,8,10)
InChIKeyCPPSXBIATWHNMJ-UHFFFAOYSA-N
MW179.18 g/mol
LogP1.35
Rot. Bonds4

About 4-(2-azidoethoxy)pyridin-2-amine

4-(2-azidoethoxy)pyridin-2-amine (PubChem CID 169237712) has the molecular formula C7H9N5O and a molecular weight of 179.18 g/mol. Its IUPAC name is 4-(2-azidoethoxy)pyridin-2-amine.

Molecular Properties

Compound Name4-(2-azidoethoxy)pyridin-2-amine
PubChem CID169237712
Molecular FormulaC7H9N5O
Molecular Weight179.18 g/mol
Exact Mass179.08
IUPAC Name4-(2-azidoethoxy)pyridin-2-amine
SMILES[N-]=[N+]=NCCOc1ccnc(N)c1
InChIInChI=1S/C7H9N5O/c8-7-5-6(1-2-10-7)13-4-3-11-12-9/h1-2,5H,3-4H2,(H2,8,10)
InChIKeyCPPSXBIATWHNMJ-UHFFFAOYSA-N
XLogP1.35
TPSA96.90 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.18
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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 4-(2-azidoethoxy)pyridin-2-amine?
The IUPAC name of 4-(2-azidoethoxy)pyridin-2-amine (CID 169237712) is 4-(2-azidoethoxy)pyridin-2-amine.
What is the SMILES notation for 4-(2-azidoethoxy)pyridin-2-amine?
The canonical SMILES for 4-(2-azidoethoxy)pyridin-2-amine is [N-]=[N+]=NCCOc1ccnc(N)c1.
What is the InChIKey of 4-(2-azidoethoxy)pyridin-2-amine?
The InChIKey is CPPSXBIATWHNMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N5O/c8-7-5-6(1-2-10-7)13-4-3-11-12-9/h1-2,5H,3-4H2,(H2,8,10).
What are the key properties of 4-(2-azidoethoxy)pyridin-2-amine?
4-(2-azidoethoxy)pyridin-2-amine has a molecular weight of 179.18 g/mol, XLogP of 1.35, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-azidoethoxy)pyridin-2-amine is sourced from PubChem (CID 169237712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).