1-methyl-5-pyrrol-1-ylpyrazol-4-amine

C8H10N4 — CID 10867313

IUPAC1-methyl-5-pyrrol-1-ylpyrazol-4-amine
SMILESCn1ncc(N)c1-n1cccc1
InChIInChI=1S/C8H10N4/c1-11-8(7(9)6-10-11)12-4-2-3-5-12/h2-6H,9H2,1H3
InChIKeyXRTDYAOBUYCDJC-UHFFFAOYSA-N
MW162.20 g/mol
LogP0.79
Rot. Bonds1

About 1-methyl-5-pyrrol-1-ylpyrazol-4-amine

1-methyl-5-pyrrol-1-ylpyrazol-4-amine (PubChem CID 10867313) has the molecular formula C8H10N4 and a molecular weight of 162.20 g/mol. Its IUPAC name is 1-methyl-5-pyrrol-1-ylpyrazol-4-amine.

Molecular Properties

Compound Name1-methyl-5-pyrrol-1-ylpyrazol-4-amine
PubChem CID10867313
Molecular FormulaC8H10N4
Molecular Weight162.20 g/mol
Exact Mass162.09
IUPAC Name1-methyl-5-pyrrol-1-ylpyrazol-4-amine
SMILESCn1ncc(N)c1-n1cccc1
InChIInChI=1S/C8H10N4/c1-11-8(7(9)6-10-11)12-4-2-3-5-12/h2-6H,9H2,1H3
InChIKeyXRTDYAOBUYCDJC-UHFFFAOYSA-N
XLogP0.79
TPSA48.77 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.20
LogP ≤ 50.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-methyl-5-pyrrol-1-ylpyrazol-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 1-methyl-5-pyrrol-1-ylpyrazol-4-amine?
The IUPAC name of 1-methyl-5-pyrrol-1-ylpyrazol-4-amine (CID 10867313) is 1-methyl-5-pyrrol-1-ylpyrazol-4-amine.
What is the SMILES notation for 1-methyl-5-pyrrol-1-ylpyrazol-4-amine?
The canonical SMILES for 1-methyl-5-pyrrol-1-ylpyrazol-4-amine is Cn1ncc(N)c1-n1cccc1.
What is the InChIKey of 1-methyl-5-pyrrol-1-ylpyrazol-4-amine?
The InChIKey is XRTDYAOBUYCDJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N4/c1-11-8(7(9)6-10-11)12-4-2-3-5-12/h2-6H,9H2,1H3.
What are the key properties of 1-methyl-5-pyrrol-1-ylpyrazol-4-amine?
1-methyl-5-pyrrol-1-ylpyrazol-4-amine has a molecular weight of 162.20 g/mol, XLogP of 0.79, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-5-pyrrol-1-ylpyrazol-4-amine is sourced from PubChem (CID 10867313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).