4H-imidazol-5-amine

C3H5N3 — CID 12744661

IUPAC4H-imidazol-5-amine
SMILESNC1=NC=NC1
InChIInChI=1S/C3H5N3/c4-3-1-5-2-6-3/h2H,1H2,(H2,4,5,6)
InChIKeyOULQIRTYSJHFKP-UHFFFAOYSA-N
MW83.09 g/mol
LogP-0.61
Rot. Bonds

About 4H-imidazol-5-amine

4H-imidazol-5-amine (PubChem CID 12744661) has the molecular formula C3H5N3 and a molecular weight of 83.09 g/mol. Its IUPAC name is 4H-imidazol-5-amine.

Molecular Properties

Compound Name4H-imidazol-5-amine
PubChem CID12744661
Molecular FormulaC3H5N3
Molecular Weight83.09 g/mol
Exact Mass83.05
IUPAC Name4H-imidazol-5-amine
SMILESNC1=NC=NC1
InChIInChI=1S/C3H5N3/c4-3-1-5-2-6-3/h2H,1H2,(H2,4,5,6)
InChIKeyOULQIRTYSJHFKP-UHFFFAOYSA-N
XLogP-0.61
TPSA50.74 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50083.09
LogP ≤ 5-0.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4H-imidazol-5-amine?
The IUPAC name of 4H-imidazol-5-amine (CID 12744661) is 4H-imidazol-5-amine.
What is the SMILES notation for 4H-imidazol-5-amine?
The canonical SMILES for 4H-imidazol-5-amine is NC1=NC=NC1.
What is the InChIKey of 4H-imidazol-5-amine?
The InChIKey is OULQIRTYSJHFKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H5N3/c4-3-1-5-2-6-3/h2H,1H2,(H2,4,5,6).
What are the key properties of 4H-imidazol-5-amine?
4H-imidazol-5-amine has a molecular weight of 83.09 g/mol, XLogP of -0.61, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4H-imidazol-5-amine is sourced from PubChem (CID 12744661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).