4H-imidazol-2-amine;hydrochloride

C3H6ClN3 — CID 55284097

IUPAC4H-imidazol-2-amine;hydrochloride
SMILESCl.NC1=NCC=N1
InChIInChI=1S/C3H5N3.ClH/c4-3-5-1-2-6-3;/h1H,2H2,(H2,4,6);1H
InChIKeyTZEFLFTUKBJTJA-UHFFFAOYSA-N
MW119.56 g/mol
LogP-0.19
Rot. Bonds

About 4H-imidazol-2-amine;hydrochloride

4H-imidazol-2-amine;hydrochloride (PubChem CID 55284097) has the molecular formula C3H6ClN3 and a molecular weight of 119.56 g/mol. Its IUPAC name is 4H-imidazol-2-amine;hydrochloride.

Molecular Properties

Compound Name4H-imidazol-2-amine;hydrochloride
PubChem CID55284097
Molecular FormulaC3H6ClN3
Molecular Weight119.56 g/mol
Exact Mass119.03
IUPAC Name4H-imidazol-2-amine;hydrochloride
SMILESCl.NC1=NCC=N1
InChIInChI=1S/C3H5N3.ClH/c4-3-5-1-2-6-3;/h1H,2H2,(H2,4,6);1H
InChIKeyTZEFLFTUKBJTJA-UHFFFAOYSA-N
XLogP-0.19
TPSA50.74 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500119.56
LogP ≤ 5-0.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4H-imidazol-2-amine;hydrochloride?
The IUPAC name of 4H-imidazol-2-amine;hydrochloride (CID 55284097) is 4H-imidazol-2-amine;hydrochloride.
What is the SMILES notation for 4H-imidazol-2-amine;hydrochloride?
The canonical SMILES for 4H-imidazol-2-amine;hydrochloride is Cl.NC1=NCC=N1.
What is the InChIKey of 4H-imidazol-2-amine;hydrochloride?
The InChIKey is TZEFLFTUKBJTJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H5N3.ClH/c4-3-5-1-2-6-3;/h1H,2H2,(H2,4,6);1H.
What are the key properties of 4H-imidazol-2-amine;hydrochloride?
4H-imidazol-2-amine;hydrochloride has a molecular weight of 119.56 g/mol, XLogP of -0.19, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4H-imidazol-2-amine;hydrochloride is sourced from PubChem (CID 55284097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).