1,2-dihydroimidazol-5-one;hydrochloride

C3H5ClN2O — CID 69192410

IUPAC1,2-dihydroimidazol-5-one;hydrochloride
SMILESCl.O=C1C=NCN1
InChIInChI=1S/C3H4N2O.ClH/c6-3-1-4-2-5-3;/h1H,2H2,(H,5,6);1H
InChIKeyAZCIPDFTQMFYNH-UHFFFAOYSA-N
MW120.54 g/mol
LogP-0.43
Rot. Bonds

About 1,2-dihydroimidazol-5-one;hydrochloride

1,2-dihydroimidazol-5-one;hydrochloride (PubChem CID 69192410) has the molecular formula C3H5ClN2O and a molecular weight of 120.54 g/mol. Its IUPAC name is 1,2-dihydroimidazol-5-one;hydrochloride.

Molecular Properties

Compound Name1,2-dihydroimidazol-5-one;hydrochloride
PubChem CID69192410
Molecular FormulaC3H5ClN2O
Molecular Weight120.54 g/mol
Exact Mass120.01
IUPAC Name1,2-dihydroimidazol-5-one;hydrochloride
SMILESCl.O=C1C=NCN1
InChIInChI=1S/C3H4N2O.ClH/c6-3-1-4-2-5-3;/h1H,2H2,(H,5,6);1H
InChIKeyAZCIPDFTQMFYNH-UHFFFAOYSA-N
XLogP-0.43
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500120.54
LogP ≤ 5-0.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,2-dihydroimidazol-5-one;hydrochloride?
The IUPAC name of 1,2-dihydroimidazol-5-one;hydrochloride (CID 69192410) is 1,2-dihydroimidazol-5-one;hydrochloride.
What is the SMILES notation for 1,2-dihydroimidazol-5-one;hydrochloride?
The canonical SMILES for 1,2-dihydroimidazol-5-one;hydrochloride is Cl.O=C1C=NCN1.
What is the InChIKey of 1,2-dihydroimidazol-5-one;hydrochloride?
The InChIKey is AZCIPDFTQMFYNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H4N2O.ClH/c6-3-1-4-2-5-3;/h1H,2H2,(H,5,6);1H.
What are the key properties of 1,2-dihydroimidazol-5-one;hydrochloride?
1,2-dihydroimidazol-5-one;hydrochloride has a molecular weight of 120.54 g/mol, XLogP of -0.43, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dihydroimidazol-5-one;hydrochloride is sourced from PubChem (CID 69192410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).