(6-hydrazinyl-5-methyl-3-pyridinyl)-methoxyazanium

C7H13N4O+ — CID 144749909

IUPAC(6-hydrazinyl-5-methyl-3-pyridinyl)-methoxyazanium
SMILESCO[NH2+]c1cnc(NN)c(C)c1
InChIInChI=1S/C7H12N4O/c1-5-3-6(11-12-2)4-9-7(5)10-8/h3-4,11H,8H2,1-2H3,(H,9,10)/p+1
InChIKeyMIHJJXGNAPZTKQ-UHFFFAOYSA-O
MW169.21 g/mol
LogP-0.57
Rot. Bonds3

About (6-hydrazinyl-5-methyl-3-pyridinyl)-methoxyazanium

(6-hydrazinyl-5-methyl-3-pyridinyl)-methoxyazanium (PubChem CID 144749909) has the molecular formula C7H13N4O+ and a molecular weight of 169.21 g/mol. Its IUPAC name is (6-hydrazinyl-5-methyl-3-pyridinyl)-methoxyazanium.

Molecular Properties

Compound Name(6-hydrazinyl-5-methyl-3-pyridinyl)-methoxyazanium
PubChem CID144749909
Molecular FormulaC7H13N4O+
Molecular Weight169.21 g/mol
Exact Mass169.11
IUPAC Name(6-hydrazinyl-5-methyl-3-pyridinyl)-methoxyazanium
SMILESCO[NH2+]c1cnc(NN)c(C)c1
InChIInChI=1S/C7H12N4O/c1-5-3-6(11-12-2)4-9-7(5)10-8/h3-4,11H,8H2,1-2H3,(H,9,10)/p+1
InChIKeyMIHJJXGNAPZTKQ-UHFFFAOYSA-O
XLogP-0.57
TPSA76.78 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.21
LogP ≤ 5-0.57
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (6-hydrazinyl-5-methyl-3-pyridinyl)-methoxyazanium?
The IUPAC name of (6-hydrazinyl-5-methyl-3-pyridinyl)-methoxyazanium (CID 144749909) is (6-hydrazinyl-5-methyl-3-pyridinyl)-methoxyazanium.
What is the SMILES notation for (6-hydrazinyl-5-methyl-3-pyridinyl)-methoxyazanium?
The canonical SMILES for (6-hydrazinyl-5-methyl-3-pyridinyl)-methoxyazanium is CO[NH2+]c1cnc(NN)c(C)c1.
What is the InChIKey of (6-hydrazinyl-5-methyl-3-pyridinyl)-methoxyazanium?
The InChIKey is MIHJJXGNAPZTKQ-UHFFFAOYSA-O. The full InChI is InChI=1S/C7H12N4O/c1-5-3-6(11-12-2)4-9-7(5)10-8/h3-4,11H,8H2,1-2H3,(H,9,10)/p+1.
What are the key properties of (6-hydrazinyl-5-methyl-3-pyridinyl)-methoxyazanium?
(6-hydrazinyl-5-methyl-3-pyridinyl)-methoxyazanium has a molecular weight of 169.21 g/mol, XLogP of -0.57, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (6-hydrazinyl-5-methyl-3-pyridinyl)-methoxyazanium is sourced from PubChem (CID 144749909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).