N-[(4-ethyl-1,2,4-triazol-3-yl)methyl]-6-hydrazinylpyridin-2-amine

C10H15N7 — CID 106304580

IUPACN-[(4-ethyl-1,2,4-triazol-3-yl)methyl]-6-hydrazinylpyridin-2-amine
SMILESCCn1cnnc1CNc1cccc(NN)n1
InChIInChI=1S/C10H15N7/c1-2-17-7-13-16-10(17)6-12-8-4-3-5-9(14-8)15-11/h3-5,7H,2,6,11H2,1H3,(H2,12,14,15)
InChIKeyACLZDJGWFOJJLZ-UHFFFAOYSA-N
MW233.28 g/mol
LogP0.59
Rot. Bonds5

About N-[(4-ethyl-1,2,4-triazol-3-yl)methyl]-6-hydrazinylpyridin-2-amine

N-[(4-ethyl-1,2,4-triazol-3-yl)methyl]-6-hydrazinylpyridin-2-amine (PubChem CID 106304580) has the molecular formula C10H15N7 and a molecular weight of 233.28 g/mol. Its IUPAC name is N-[(4-ethyl-1,2,4-triazol-3-yl)methyl]-6-hydrazinylpyridin-2-amine.

Molecular Properties

Compound NameN-[(4-ethyl-1,2,4-triazol-3-yl)methyl]-6-hydrazinylpyridin-2-amine
PubChem CID106304580
Molecular FormulaC10H15N7
Molecular Weight233.28 g/mol
Exact Mass233.14
IUPAC NameN-[(4-ethyl-1,2,4-triazol-3-yl)methyl]-6-hydrazinylpyridin-2-amine
SMILESCCn1cnnc1CNc1cccc(NN)n1
InChIInChI=1S/C10H15N7/c1-2-17-7-13-16-10(17)6-12-8-4-3-5-9(14-8)15-11/h3-5,7H,2,6,11H2,1H3,(H2,12,14,15)
InChIKeyACLZDJGWFOJJLZ-UHFFFAOYSA-N
XLogP0.59
TPSA93.68 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.28
LogP ≤ 50.59
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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 N-[(4-ethyl-1,2,4-triazol-3-yl)methyl]-6-hydrazinylpyridin-2-amine?
The IUPAC name of N-[(4-ethyl-1,2,4-triazol-3-yl)methyl]-6-hydrazinylpyridin-2-amine (CID 106304580) is N-[(4-ethyl-1,2,4-triazol-3-yl)methyl]-6-hydrazinylpyridin-2-amine.
What is the SMILES notation for N-[(4-ethyl-1,2,4-triazol-3-yl)methyl]-6-hydrazinylpyridin-2-amine?
The canonical SMILES for N-[(4-ethyl-1,2,4-triazol-3-yl)methyl]-6-hydrazinylpyridin-2-amine is CCn1cnnc1CNc1cccc(NN)n1.
What is the InChIKey of N-[(4-ethyl-1,2,4-triazol-3-yl)methyl]-6-hydrazinylpyridin-2-amine?
The InChIKey is ACLZDJGWFOJJLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N7/c1-2-17-7-13-16-10(17)6-12-8-4-3-5-9(14-8)15-11/h3-5,7H,2,6,11H2,1H3,(H2,12,14,15).
What are the key properties of N-[(4-ethyl-1,2,4-triazol-3-yl)methyl]-6-hydrazinylpyridin-2-amine?
N-[(4-ethyl-1,2,4-triazol-3-yl)methyl]-6-hydrazinylpyridin-2-amine has a molecular weight of 233.28 g/mol, XLogP of 0.59, 5 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-ethyl-1,2,4-triazol-3-yl)methyl]-6-hydrazinylpyridin-2-amine is sourced from PubChem (CID 106304580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).