1H-imidazole;pyridine;hydrochloride

C8H10ClN3 — CID 66994146

IUPAC1H-imidazole;pyridine;hydrochloride
SMILESCl.c1c[nH]cn1.c1ccncc1
InChIInChI=1S/C5H5N.C3H4N2.ClH/c1-2-4-6-5-3-1;1-2-5-3-4-1;/h1-5H;1-3H,(H,4,5);1H
InChIKeyDCVZMZDPKNWTKX-UHFFFAOYSA-N
MW183.64 g/mol
LogP1.91
Rot. Bonds

About 1H-imidazole;pyridine;hydrochloride

1H-imidazole;pyridine;hydrochloride (PubChem CID 66994146) has the molecular formula C8H10ClN3 and a molecular weight of 183.64 g/mol. Its IUPAC name is 1H-imidazole;pyridine;hydrochloride.

Molecular Properties

Compound Name1H-imidazole;pyridine;hydrochloride
PubChem CID66994146
Molecular FormulaC8H10ClN3
Molecular Weight183.64 g/mol
Exact Mass183.06
IUPAC Name1H-imidazole;pyridine;hydrochloride
SMILESCl.c1c[nH]cn1.c1ccncc1
InChIInChI=1S/C5H5N.C3H4N2.ClH/c1-2-4-6-5-3-1;1-2-5-3-4-1;/h1-5H;1-3H,(H,4,5);1H
InChIKeyDCVZMZDPKNWTKX-UHFFFAOYSA-N
XLogP1.91
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.64
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1H-imidazole;pyridine;hydrochloride?
The IUPAC name of 1H-imidazole;pyridine;hydrochloride (CID 66994146) is 1H-imidazole;pyridine;hydrochloride.
What is the SMILES notation for 1H-imidazole;pyridine;hydrochloride?
The canonical SMILES for 1H-imidazole;pyridine;hydrochloride is Cl.c1c[nH]cn1.c1ccncc1.
What is the InChIKey of 1H-imidazole;pyridine;hydrochloride?
The InChIKey is DCVZMZDPKNWTKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5N.C3H4N2.ClH/c1-2-4-6-5-3-1;1-2-5-3-4-1;/h1-5H;1-3H,(H,4,5);1H.
What are the key properties of 1H-imidazole;pyridine;hydrochloride?
1H-imidazole;pyridine;hydrochloride has a molecular weight of 183.64 g/mol, XLogP of 1.91, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1H-imidazole;pyridine;hydrochloride is sourced from PubChem (CID 66994146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).