1H-imidazole;sulfanylidenephosphane

C3H5N2PS — CID 174668567

IUPAC1H-imidazole;sulfanylidenephosphane
SMILESP=S.c1c[nH]cn1
InChIInChI=1S/C3H4N2.HPS/c1-2-5-3-4-1;1-2/h1-3H,(H,4,5);1H
InChIKeyQCQIQZLZLJABFA-UHFFFAOYSA-N
MW132.13 g/mol
LogP1.00
Rot. Bonds

About 1H-imidazole;sulfanylidenephosphane

1H-imidazole;sulfanylidenephosphane (PubChem CID 174668567) has the molecular formula C3H5N2PS and a molecular weight of 132.13 g/mol. Its IUPAC name is 1H-imidazole;sulfanylidenephosphane.

Molecular Properties

Compound Name1H-imidazole;sulfanylidenephosphane
PubChem CID174668567
Molecular FormulaC3H5N2PS
Molecular Weight132.13 g/mol
Exact Mass131.99
IUPAC Name1H-imidazole;sulfanylidenephosphane
SMILESP=S.c1c[nH]cn1
InChIInChI=1S/C3H4N2.HPS/c1-2-5-3-4-1;1-2/h1-3H,(H,4,5);1H
InChIKeyQCQIQZLZLJABFA-UHFFFAOYSA-N
XLogP1.00
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.13
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1H-imidazole;sulfanylidenephosphane?
The IUPAC name of 1H-imidazole;sulfanylidenephosphane (CID 174668567) is 1H-imidazole;sulfanylidenephosphane.
What is the SMILES notation for 1H-imidazole;sulfanylidenephosphane?
The canonical SMILES for 1H-imidazole;sulfanylidenephosphane is P=S.c1c[nH]cn1.
What is the InChIKey of 1H-imidazole;sulfanylidenephosphane?
The InChIKey is QCQIQZLZLJABFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H4N2.HPS/c1-2-5-3-4-1;1-2/h1-3H,(H,4,5);1H.
What are the key properties of 1H-imidazole;sulfanylidenephosphane?
1H-imidazole;sulfanylidenephosphane has a molecular weight of 132.13 g/mol, XLogP of 1.00, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1H-imidazole;sulfanylidenephosphane is sourced from PubChem (CID 174668567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).