6-hydrazinyl-N-[2-(1-methylpyrazol-4-yl)ethyl]-4-(trifluoromethyl)pyridin-2-amine

C12H15F3N6 — CID 102720907

IUPAC6-hydrazinyl-N-[2-(1-methylpyrazol-4-yl)ethyl]-4-(trifluoromethyl)pyridin-2-amine
SMILESCn1cc(CCNc2cc(C(F)(F)F)cc(NN)n2)cn1
InChIInChI=1S/C12H15F3N6/c1-21-7-8(6-18-21)2-3-17-10-4-9(12(13,14)15)5-11(19-10)20-16/h4-7H,2-3,16H2,1H3,(H2,17,19,20)
InChIKeyOSKZDQWUECYWHR-UHFFFAOYSA-N
MW300.29 g/mol
LogP1.77
Rot. Bonds5

About 6-hydrazinyl-N-[2-(1-methylpyrazol-4-yl)ethyl]-4-(trifluoromethyl)pyridin-2-amine

6-hydrazinyl-N-[2-(1-methylpyrazol-4-yl)ethyl]-4-(trifluoromethyl)pyridin-2-amine (PubChem CID 102720907) has the molecular formula C12H15F3N6 and a molecular weight of 300.29 g/mol. Its IUPAC name is 6-hydrazinyl-N-[2-(1-methylpyrazol-4-yl)ethyl]-4-(trifluoromethyl)pyridin-2-amine.

Molecular Properties

Compound Name6-hydrazinyl-N-[2-(1-methylpyrazol-4-yl)ethyl]-4-(trifluoromethyl)pyridin-2-amine
PubChem CID102720907
Molecular FormulaC12H15F3N6
Molecular Weight300.29 g/mol
Exact Mass300.13
IUPAC Name6-hydrazinyl-N-[2-(1-methylpyrazol-4-yl)ethyl]-4-(trifluoromethyl)pyridin-2-amine
SMILESCn1cc(CCNc2cc(C(F)(F)F)cc(NN)n2)cn1
InChIInChI=1S/C12H15F3N6/c1-21-7-8(6-18-21)2-3-17-10-4-9(12(13,14)15)5-11(19-10)20-16/h4-7H,2-3,16H2,1H3,(H2,17,19,20)
InChIKeyOSKZDQWUECYWHR-UHFFFAOYSA-N
XLogP1.77
TPSA80.79 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.29
LogP ≤ 51.77
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze 6-hydrazinyl-N-[2-(1-methylpyrazol-4-yl)ethyl]-4-(trifluoromethyl)pyridin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-hydrazinyl-N-[2-(1-methylpyrazol-4-yl)ethyl]-4-(trifluoromethyl)pyridin-2-amine?
The IUPAC name of 6-hydrazinyl-N-[2-(1-methylpyrazol-4-yl)ethyl]-4-(trifluoromethyl)pyridin-2-amine (CID 102720907) is 6-hydrazinyl-N-[2-(1-methylpyrazol-4-yl)ethyl]-4-(trifluoromethyl)pyridin-2-amine.
What is the SMILES notation for 6-hydrazinyl-N-[2-(1-methylpyrazol-4-yl)ethyl]-4-(trifluoromethyl)pyridin-2-amine?
The canonical SMILES for 6-hydrazinyl-N-[2-(1-methylpyrazol-4-yl)ethyl]-4-(trifluoromethyl)pyridin-2-amine is Cn1cc(CCNc2cc(C(F)(F)F)cc(NN)n2)cn1.
What is the InChIKey of 6-hydrazinyl-N-[2-(1-methylpyrazol-4-yl)ethyl]-4-(trifluoromethyl)pyridin-2-amine?
The InChIKey is OSKZDQWUECYWHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15F3N6/c1-21-7-8(6-18-21)2-3-17-10-4-9(12(13,14)15)5-11(19-10)20-16/h4-7H,2-3,16H2,1H3,(H2,17,19,20).
What are the key properties of 6-hydrazinyl-N-[2-(1-methylpyrazol-4-yl)ethyl]-4-(trifluoromethyl)pyridin-2-amine?
6-hydrazinyl-N-[2-(1-methylpyrazol-4-yl)ethyl]-4-(trifluoromethyl)pyridin-2-amine has a molecular weight of 300.29 g/mol, XLogP of 1.77, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-N-[2-(1-methylpyrazol-4-yl)ethyl]-4-(trifluoromethyl)pyridin-2-amine is sourced from PubChem (CID 102720907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).