4,5-dihydro-1H-imidazol-2-amine;hydrochloride

C3H8ClN3 — CID 12797539

IUPAC4,5-dihydro-1H-imidazol-2-amine;hydrochloride
SMILESCl.NC1=NCCN1
InChIInChI=1S/C3H7N3.ClH/c4-3-5-1-2-6-3;/h1-2H2,(H3,4,5,6);1H
InChIKeyRZISTNHSOMNHDE-UHFFFAOYSA-N
MW121.57 g/mol
LogP-0.67
Rot. Bonds

About 4,5-dihydro-1H-imidazol-2-amine;hydrochloride

4,5-dihydro-1H-imidazol-2-amine;hydrochloride (PubChem CID 12797539) has the molecular formula C3H8ClN3 and a molecular weight of 121.57 g/mol. Its IUPAC name is 4,5-dihydro-1H-imidazol-2-amine;hydrochloride.

Molecular Properties

Compound Name4,5-dihydro-1H-imidazol-2-amine;hydrochloride
PubChem CID12797539
Molecular FormulaC3H8ClN3
Molecular Weight121.57 g/mol
Exact Mass121.04
IUPAC Name4,5-dihydro-1H-imidazol-2-amine;hydrochloride
SMILESCl.NC1=NCCN1
InChIInChI=1S/C3H7N3.ClH/c4-3-5-1-2-6-3;/h1-2H2,(H3,4,5,6);1H
InChIKeyRZISTNHSOMNHDE-UHFFFAOYSA-N
XLogP-0.67
TPSA50.41 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500121.57
LogP ≤ 5-0.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4,5-dihydro-1H-imidazol-2-amine;hydrochloride?
The IUPAC name of 4,5-dihydro-1H-imidazol-2-amine;hydrochloride (CID 12797539) is 4,5-dihydro-1H-imidazol-2-amine;hydrochloride.
What is the SMILES notation for 4,5-dihydro-1H-imidazol-2-amine;hydrochloride?
The canonical SMILES for 4,5-dihydro-1H-imidazol-2-amine;hydrochloride is Cl.NC1=NCCN1.
What is the InChIKey of 4,5-dihydro-1H-imidazol-2-amine;hydrochloride?
The InChIKey is RZISTNHSOMNHDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7N3.ClH/c4-3-5-1-2-6-3;/h1-2H2,(H3,4,5,6);1H.
What are the key properties of 4,5-dihydro-1H-imidazol-2-amine;hydrochloride?
4,5-dihydro-1H-imidazol-2-amine;hydrochloride has a molecular weight of 121.57 g/mol, XLogP of -0.67, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-dihydro-1H-imidazol-2-amine;hydrochloride is sourced from PubChem (CID 12797539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).