2H-imidazol-4-amine

C3H5N3 — CID 12744663

IUPAC2H-imidazol-4-amine
SMILESNC1=NCN=C1
InChIInChI=1S/C3H5N3/c4-3-1-5-2-6-3/h1H,2H2,(H2,4,6)
InChIKeyINAZNUCVPFSAKI-UHFFFAOYSA-N
MW83.09 g/mol
LogP-0.61
Rot. Bonds

About 2H-imidazol-4-amine

2H-imidazol-4-amine (PubChem CID 12744663) has the molecular formula C3H5N3 and a molecular weight of 83.09 g/mol. Its IUPAC name is 2H-imidazol-4-amine.

Molecular Properties

Compound Name2H-imidazol-4-amine
PubChem CID12744663
Molecular FormulaC3H5N3
Molecular Weight83.09 g/mol
Exact Mass83.05
IUPAC Name2H-imidazol-4-amine
SMILESNC1=NCN=C1
InChIInChI=1S/C3H5N3/c4-3-1-5-2-6-3/h1H,2H2,(H2,4,6)
InChIKeyINAZNUCVPFSAKI-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 2H-imidazol-4-amine?
The IUPAC name of 2H-imidazol-4-amine (CID 12744663) is 2H-imidazol-4-amine.
What is the SMILES notation for 2H-imidazol-4-amine?
The canonical SMILES for 2H-imidazol-4-amine is NC1=NCN=C1.
What is the InChIKey of 2H-imidazol-4-amine?
The InChIKey is INAZNUCVPFSAKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H5N3/c4-3-1-5-2-6-3/h1H,2H2,(H2,4,6).
What are the key properties of 2H-imidazol-4-amine?
2H-imidazol-4-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 2H-imidazol-4-amine is sourced from PubChem (CID 12744663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).