2-pyrrol-1-yl-1H-imidazol-5-amine

C7H8N4 — CID 70533309

IUPAC2-pyrrol-1-yl-1H-imidazol-5-amine
SMILESNc1cnc(-n2cccc2)[nH]1
InChIInChI=1S/C7H8N4/c8-6-5-9-7(10-6)11-3-1-2-4-11/h1-5H,8H2,(H,9,10)
InChIKeyVYAUWPFWQCDWIN-UHFFFAOYSA-N
MW148.17 g/mol
LogP0.78
Rot. Bonds1

About 2-pyrrol-1-yl-1H-imidazol-5-amine

2-pyrrol-1-yl-1H-imidazol-5-amine (PubChem CID 70533309) has the molecular formula C7H8N4 and a molecular weight of 148.17 g/mol. Its IUPAC name is 2-pyrrol-1-yl-1H-imidazol-5-amine.

Molecular Properties

Compound Name2-pyrrol-1-yl-1H-imidazol-5-amine
PubChem CID70533309
Molecular FormulaC7H8N4
Molecular Weight148.17 g/mol
Exact Mass148.07
IUPAC Name2-pyrrol-1-yl-1H-imidazol-5-amine
SMILESNc1cnc(-n2cccc2)[nH]1
InChIInChI=1S/C7H8N4/c8-6-5-9-7(10-6)11-3-1-2-4-11/h1-5H,8H2,(H,9,10)
InChIKeyVYAUWPFWQCDWIN-UHFFFAOYSA-N
XLogP0.78
TPSA59.63 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.17
LogP ≤ 50.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-pyrrol-1-yl-1H-imidazol-5-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 2-pyrrol-1-yl-1H-imidazol-5-amine?
The IUPAC name of 2-pyrrol-1-yl-1H-imidazol-5-amine (CID 70533309) is 2-pyrrol-1-yl-1H-imidazol-5-amine.
What is the SMILES notation for 2-pyrrol-1-yl-1H-imidazol-5-amine?
The canonical SMILES for 2-pyrrol-1-yl-1H-imidazol-5-amine is Nc1cnc(-n2cccc2)[nH]1.
What is the InChIKey of 2-pyrrol-1-yl-1H-imidazol-5-amine?
The InChIKey is VYAUWPFWQCDWIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N4/c8-6-5-9-7(10-6)11-3-1-2-4-11/h1-5H,8H2,(H,9,10).
What are the key properties of 2-pyrrol-1-yl-1H-imidazol-5-amine?
2-pyrrol-1-yl-1H-imidazol-5-amine has a molecular weight of 148.17 g/mol, XLogP of 0.78, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyrrol-1-yl-1H-imidazol-5-amine is sourced from PubChem (CID 70533309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).