7-(1-methylpyrazol-4-yl)pyrrolo[2,1-f][1,2,4]triazin-2-amine

C10H10N6 — CID 169118096

IUPAC7-(1-methylpyrazol-4-yl)pyrrolo[2,1-f][1,2,4]triazin-2-amine
SMILESCn1cc(-c2ccc3cnc(N)nn23)cn1
InChIInChI=1S/C10H10N6/c1-15-6-7(4-13-15)9-3-2-8-5-12-10(11)14-16(8)9/h2-6H,1H3,(H2,11,14)
InChIKeyNHEQGNOBDYPDEY-UHFFFAOYSA-N
MW214.23 g/mol
LogP0.71
Rot. Bonds1

About 7-(1-methylpyrazol-4-yl)pyrrolo[2,1-f][1,2,4]triazin-2-amine

7-(1-methylpyrazol-4-yl)pyrrolo[2,1-f][1,2,4]triazin-2-amine (PubChem CID 169118096) has the molecular formula C10H10N6 and a molecular weight of 214.23 g/mol. Its IUPAC name is 7-(1-methylpyrazol-4-yl)pyrrolo[2,1-f][1,2,4]triazin-2-amine.

Molecular Properties

Compound Name7-(1-methylpyrazol-4-yl)pyrrolo[2,1-f][1,2,4]triazin-2-amine
PubChem CID169118096
Molecular FormulaC10H10N6
Molecular Weight214.23 g/mol
Exact Mass214.10
IUPAC Name7-(1-methylpyrazol-4-yl)pyrrolo[2,1-f][1,2,4]triazin-2-amine
SMILESCn1cc(-c2ccc3cnc(N)nn23)cn1
InChIInChI=1S/C10H10N6/c1-15-6-7(4-13-15)9-3-2-8-5-12-10(11)14-16(8)9/h2-6H,1H3,(H2,11,14)
InChIKeyNHEQGNOBDYPDEY-UHFFFAOYSA-N
XLogP0.71
TPSA74.03 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.23
LogP ≤ 50.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 7-(1-methylpyrazol-4-yl)pyrrolo[2,1-f][1,2,4]triazin-2-amine?
The IUPAC name of 7-(1-methylpyrazol-4-yl)pyrrolo[2,1-f][1,2,4]triazin-2-amine (CID 169118096) is 7-(1-methylpyrazol-4-yl)pyrrolo[2,1-f][1,2,4]triazin-2-amine.
What is the SMILES notation for 7-(1-methylpyrazol-4-yl)pyrrolo[2,1-f][1,2,4]triazin-2-amine?
The canonical SMILES for 7-(1-methylpyrazol-4-yl)pyrrolo[2,1-f][1,2,4]triazin-2-amine is Cn1cc(-c2ccc3cnc(N)nn23)cn1.
What is the InChIKey of 7-(1-methylpyrazol-4-yl)pyrrolo[2,1-f][1,2,4]triazin-2-amine?
The InChIKey is NHEQGNOBDYPDEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N6/c1-15-6-7(4-13-15)9-3-2-8-5-12-10(11)14-16(8)9/h2-6H,1H3,(H2,11,14).
What are the key properties of 7-(1-methylpyrazol-4-yl)pyrrolo[2,1-f][1,2,4]triazin-2-amine?
7-(1-methylpyrazol-4-yl)pyrrolo[2,1-f][1,2,4]triazin-2-amine has a molecular weight of 214.23 g/mol, XLogP of 0.71, 1 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(1-methylpyrazol-4-yl)pyrrolo[2,1-f][1,2,4]triazin-2-amine is sourced from PubChem (CID 169118096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).