N-methylpyrrolo[2,1-f][1,2,4]triazin-4-amine

C7H8N4 — CID 89101960

IUPACN-methylpyrrolo[2,1-f][1,2,4]triazin-4-amine
SMILESCNc1ncnn2cccc12
InChIInChI=1S/C7H8N4/c1-8-7-6-3-2-4-11(6)10-5-9-7/h2-5H,1H3,(H,8,9,10)
InChIKeyATFRCSUHHNRRLZ-UHFFFAOYSA-N
MW148.17 g/mol
LogP0.77
Rot. Bonds1

About N-methylpyrrolo[2,1-f][1,2,4]triazin-4-amine

N-methylpyrrolo[2,1-f][1,2,4]triazin-4-amine (PubChem CID 89101960) has the molecular formula C7H8N4 and a molecular weight of 148.17 g/mol. Its IUPAC name is N-methylpyrrolo[2,1-f][1,2,4]triazin-4-amine.

Molecular Properties

Compound NameN-methylpyrrolo[2,1-f][1,2,4]triazin-4-amine
PubChem CID89101960
Molecular FormulaC7H8N4
Molecular Weight148.17 g/mol
Exact Mass148.07
IUPAC NameN-methylpyrrolo[2,1-f][1,2,4]triazin-4-amine
SMILESCNc1ncnn2cccc12
InChIInChI=1S/C7H8N4/c1-8-7-6-3-2-4-11(6)10-5-9-7/h2-5H,1H3,(H,8,9,10)
InChIKeyATFRCSUHHNRRLZ-UHFFFAOYSA-N
XLogP0.77
TPSA42.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.17
LogP ≤ 50.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-methylpyrrolo[2,1-f][1,2,4]triazin-4-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 N-methylpyrrolo[2,1-f][1,2,4]triazin-4-amine?
The IUPAC name of N-methylpyrrolo[2,1-f][1,2,4]triazin-4-amine (CID 89101960) is N-methylpyrrolo[2,1-f][1,2,4]triazin-4-amine.
What is the SMILES notation for N-methylpyrrolo[2,1-f][1,2,4]triazin-4-amine?
The canonical SMILES for N-methylpyrrolo[2,1-f][1,2,4]triazin-4-amine is CNc1ncnn2cccc12.
What is the InChIKey of N-methylpyrrolo[2,1-f][1,2,4]triazin-4-amine?
The InChIKey is ATFRCSUHHNRRLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N4/c1-8-7-6-3-2-4-11(6)10-5-9-7/h2-5H,1H3,(H,8,9,10).
What are the key properties of N-methylpyrrolo[2,1-f][1,2,4]triazin-4-amine?
N-methylpyrrolo[2,1-f][1,2,4]triazin-4-amine has a molecular weight of 148.17 g/mol, XLogP of 0.77, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methylpyrrolo[2,1-f][1,2,4]triazin-4-amine is sourced from PubChem (CID 89101960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).