6-[4-(6-fluoro-1H-indol-3-yl)pyrazol-1-yl]pyridazin-3-amine;methane

C16H15FN6 — CID 159302679

IUPAC6-[4-(6-fluoro-1H-indol-3-yl)pyrazol-1-yl]pyridazin-3-amine;methane
SMILESC.Nc1ccc(-n2cc(-c3c[nH]c4cc(F)ccc34)cn2)nn1
InChIInChI=1S/C15H11FN6.CH4/c16-10-1-2-11-12(7-18-13(11)5-10)9-6-19-22(8-9)15-4-3-14(17)20-21-15;/h1-8,18H,(H2,17,20);1H4
InChIKeyLBNMBHYXHDMJCR-UHFFFAOYSA-N
MW310.34 g/mol
LogP3.17
Rot. Bonds2

About 6-[4-(6-fluoro-1H-indol-3-yl)pyrazol-1-yl]pyridazin-3-amine;methane

6-[4-(6-fluoro-1H-indol-3-yl)pyrazol-1-yl]pyridazin-3-amine;methane (PubChem CID 159302679) has the molecular formula C16H15FN6 and a molecular weight of 310.34 g/mol. Its IUPAC name is 6-[4-(6-fluoro-1H-indol-3-yl)pyrazol-1-yl]pyridazin-3-amine;methane.

Molecular Properties

Compound Name6-[4-(6-fluoro-1H-indol-3-yl)pyrazol-1-yl]pyridazin-3-amine;methane
PubChem CID159302679
Molecular FormulaC16H15FN6
Molecular Weight310.34 g/mol
Exact Mass310.13
IUPAC Name6-[4-(6-fluoro-1H-indol-3-yl)pyrazol-1-yl]pyridazin-3-amine;methane
SMILESC.Nc1ccc(-n2cc(-c3c[nH]c4cc(F)ccc34)cn2)nn1
InChIInChI=1S/C15H11FN6.CH4/c16-10-1-2-11-12(7-18-13(11)5-10)9-6-19-22(8-9)15-4-3-14(17)20-21-15;/h1-8,18H,(H2,17,20);1H4
InChIKeyLBNMBHYXHDMJCR-UHFFFAOYSA-N
XLogP3.17
TPSA85.41 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.34
LogP ≤ 53.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-[4-(6-fluoro-1H-indol-3-yl)pyrazol-1-yl]pyridazin-3-amine;methane?
The IUPAC name of 6-[4-(6-fluoro-1H-indol-3-yl)pyrazol-1-yl]pyridazin-3-amine;methane (CID 159302679) is 6-[4-(6-fluoro-1H-indol-3-yl)pyrazol-1-yl]pyridazin-3-amine;methane.
What is the SMILES notation for 6-[4-(6-fluoro-1H-indol-3-yl)pyrazol-1-yl]pyridazin-3-amine;methane?
The canonical SMILES for 6-[4-(6-fluoro-1H-indol-3-yl)pyrazol-1-yl]pyridazin-3-amine;methane is C.Nc1ccc(-n2cc(-c3c[nH]c4cc(F)ccc34)cn2)nn1.
What is the InChIKey of 6-[4-(6-fluoro-1H-indol-3-yl)pyrazol-1-yl]pyridazin-3-amine;methane?
The InChIKey is LBNMBHYXHDMJCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11FN6.CH4/c16-10-1-2-11-12(7-18-13(11)5-10)9-6-19-22(8-9)15-4-3-14(17)20-21-15;/h1-8,18H,(H2,17,20);1H4.
What are the key properties of 6-[4-(6-fluoro-1H-indol-3-yl)pyrazol-1-yl]pyridazin-3-amine;methane?
6-[4-(6-fluoro-1H-indol-3-yl)pyrazol-1-yl]pyridazin-3-amine;methane has a molecular weight of 310.34 g/mol, XLogP of 3.17, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-(6-fluoro-1H-indol-3-yl)pyrazol-1-yl]pyridazin-3-amine;methane is sourced from PubChem (CID 159302679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).