6,7-dihydro-5H-pyrrolo[1,2-c]imidazol-3-amine

C6H9N3 — CID 55284251

IUPAC6,7-dihydro-5H-pyrrolo[1,2-c]imidazol-3-amine
SMILESNc1ncc2n1CCC2
InChIInChI=1S/C6H9N3/c7-6-8-4-5-2-1-3-9(5)6/h4H,1-3H2,(H2,7,8)
InChIKeyMOFUHNVZOPMOHQ-UHFFFAOYSA-N
MW123.16 g/mol
LogP0.41
Rot. Bonds

About 6,7-dihydro-5H-pyrrolo[1,2-c]imidazol-3-amine

6,7-dihydro-5H-pyrrolo[1,2-c]imidazol-3-amine (PubChem CID 55284251) has the molecular formula C6H9N3 and a molecular weight of 123.16 g/mol. Its IUPAC name is 6,7-dihydro-5H-pyrrolo[1,2-c]imidazol-3-amine.

Molecular Properties

Compound Name6,7-dihydro-5H-pyrrolo[1,2-c]imidazol-3-amine
PubChem CID55284251
Molecular FormulaC6H9N3
Molecular Weight123.16 g/mol
Exact Mass123.08
IUPAC Name6,7-dihydro-5H-pyrrolo[1,2-c]imidazol-3-amine
SMILESNc1ncc2n1CCC2
InChIInChI=1S/C6H9N3/c7-6-8-4-5-2-1-3-9(5)6/h4H,1-3H2,(H2,7,8)
InChIKeyMOFUHNVZOPMOHQ-UHFFFAOYSA-N
XLogP0.41
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms9
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500123.16
LogP ≤ 50.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6,7-dihydro-5H-pyrrolo[1,2-c]imidazol-3-amine?
The IUPAC name of 6,7-dihydro-5H-pyrrolo[1,2-c]imidazol-3-amine (CID 55284251) is 6,7-dihydro-5H-pyrrolo[1,2-c]imidazol-3-amine.
What is the SMILES notation for 6,7-dihydro-5H-pyrrolo[1,2-c]imidazol-3-amine?
The canonical SMILES for 6,7-dihydro-5H-pyrrolo[1,2-c]imidazol-3-amine is Nc1ncc2n1CCC2.
What is the InChIKey of 6,7-dihydro-5H-pyrrolo[1,2-c]imidazol-3-amine?
The InChIKey is MOFUHNVZOPMOHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3/c7-6-8-4-5-2-1-3-9(5)6/h4H,1-3H2,(H2,7,8).
What are the key properties of 6,7-dihydro-5H-pyrrolo[1,2-c]imidazol-3-amine?
6,7-dihydro-5H-pyrrolo[1,2-c]imidazol-3-amine has a molecular weight of 123.16 g/mol, XLogP of 0.41, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-dihydro-5H-pyrrolo[1,2-c]imidazol-3-amine is sourced from PubChem (CID 55284251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).