1-(5-fluoro-6-hydrazinyl-2-methylpyrimidin-4-yl)-N,N,4,4-tetramethylpyrrolidin-3-amine

C13H23FN6 — CID 66936077

IUPAC1-(5-fluoro-6-hydrazinyl-2-methylpyrimidin-4-yl)-N,N,4,4-tetramethylpyrrolidin-3-amine
SMILESCc1nc(NN)c(F)c(N2CC(N(C)C)C(C)(C)C2)n1
InChIInChI=1S/C13H23FN6/c1-8-16-11(18-15)10(14)12(17-8)20-6-9(19(4)5)13(2,3)7-20/h9H,6-7,15H2,1-5H3,(H,16,17,18)
InChIKeyDWQHOGGLYSBEDK-UHFFFAOYSA-N
MW282.37 g/mol
LogP0.99
Rot. Bonds3

About 1-(5-fluoro-6-hydrazinyl-2-methylpyrimidin-4-yl)-N,N,4,4-tetramethylpyrrolidin-3-amine

1-(5-fluoro-6-hydrazinyl-2-methylpyrimidin-4-yl)-N,N,4,4-tetramethylpyrrolidin-3-amine (PubChem CID 66936077) has the molecular formula C13H23FN6 and a molecular weight of 282.37 g/mol. Its IUPAC name is 1-(5-fluoro-6-hydrazinyl-2-methylpyrimidin-4-yl)-N,N,4,4-tetramethylpyrrolidin-3-amine.

Molecular Properties

Compound Name1-(5-fluoro-6-hydrazinyl-2-methylpyrimidin-4-yl)-N,N,4,4-tetramethylpyrrolidin-3-amine
PubChem CID66936077
Molecular FormulaC13H23FN6
Molecular Weight282.37 g/mol
Exact Mass282.20
IUPAC Name1-(5-fluoro-6-hydrazinyl-2-methylpyrimidin-4-yl)-N,N,4,4-tetramethylpyrrolidin-3-amine
SMILESCc1nc(NN)c(F)c(N2CC(N(C)C)C(C)(C)C2)n1
InChIInChI=1S/C13H23FN6/c1-8-16-11(18-15)10(14)12(17-8)20-6-9(19(4)5)13(2,3)7-20/h9H,6-7,15H2,1-5H3,(H,16,17,18)
InChIKeyDWQHOGGLYSBEDK-UHFFFAOYSA-N
XLogP0.99
TPSA70.31 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.37
LogP ≤ 50.99
H-Bond Donors ≤ 52
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 1-(5-fluoro-6-hydrazinyl-2-methylpyrimidin-4-yl)-N,N,4,4-tetramethylpyrrolidin-3-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 1-(5-fluoro-6-hydrazinyl-2-methylpyrimidin-4-yl)-N,N,4,4-tetramethylpyrrolidin-3-amine?
The IUPAC name of 1-(5-fluoro-6-hydrazinyl-2-methylpyrimidin-4-yl)-N,N,4,4-tetramethylpyrrolidin-3-amine (CID 66936077) is 1-(5-fluoro-6-hydrazinyl-2-methylpyrimidin-4-yl)-N,N,4,4-tetramethylpyrrolidin-3-amine.
What is the SMILES notation for 1-(5-fluoro-6-hydrazinyl-2-methylpyrimidin-4-yl)-N,N,4,4-tetramethylpyrrolidin-3-amine?
The canonical SMILES for 1-(5-fluoro-6-hydrazinyl-2-methylpyrimidin-4-yl)-N,N,4,4-tetramethylpyrrolidin-3-amine is Cc1nc(NN)c(F)c(N2CC(N(C)C)C(C)(C)C2)n1.
What is the InChIKey of 1-(5-fluoro-6-hydrazinyl-2-methylpyrimidin-4-yl)-N,N,4,4-tetramethylpyrrolidin-3-amine?
The InChIKey is DWQHOGGLYSBEDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23FN6/c1-8-16-11(18-15)10(14)12(17-8)20-6-9(19(4)5)13(2,3)7-20/h9H,6-7,15H2,1-5H3,(H,16,17,18).
What are the key properties of 1-(5-fluoro-6-hydrazinyl-2-methylpyrimidin-4-yl)-N,N,4,4-tetramethylpyrrolidin-3-amine?
1-(5-fluoro-6-hydrazinyl-2-methylpyrimidin-4-yl)-N,N,4,4-tetramethylpyrrolidin-3-amine has a molecular weight of 282.37 g/mol, XLogP of 0.99, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-fluoro-6-hydrazinyl-2-methylpyrimidin-4-yl)-N,N,4,4-tetramethylpyrrolidin-3-amine is sourced from PubChem (CID 66936077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).