2-propan-2-yl-4H-imidazol-1-id-5-one;rhodium

C6H9N2ORh- — CID 59872601

IUPAC2-propan-2-yl-4H-imidazol-1-id-5-one;rhodium
SMILESCC(C)C1=NCC(=O)[N-]1.[Rh]
InChIInChI=1S/C6H10N2O.Rh/c1-4(2)6-7-3-5(9)8-6;/h4H,3H2,1-2H3,(H,7,8,9);/p-1
InChIKeyZHRFHOUBZNEGPS-UHFFFAOYSA-M
MW228.06 g/mol
LogP0.95
Rot. Bonds1

About 2-propan-2-yl-4H-imidazol-1-id-5-one;rhodium

2-propan-2-yl-4H-imidazol-1-id-5-one;rhodium (PubChem CID 59872601) has the molecular formula C6H9N2ORh- and a molecular weight of 228.06 g/mol. Its IUPAC name is 2-propan-2-yl-4H-imidazol-1-id-5-one;rhodium.

Molecular Properties

Compound Name2-propan-2-yl-4H-imidazol-1-id-5-one;rhodium
PubChem CID59872601
Molecular FormulaC6H9N2ORh-
Molecular Weight228.06 g/mol
Exact Mass227.98
IUPAC Name2-propan-2-yl-4H-imidazol-1-id-5-one;rhodium
SMILESCC(C)C1=NCC(=O)[N-]1.[Rh]
InChIInChI=1S/C6H10N2O.Rh/c1-4(2)6-7-3-5(9)8-6;/h4H,3H2,1-2H3,(H,7,8,9);/p-1
InChIKeyZHRFHOUBZNEGPS-UHFFFAOYSA-M
XLogP0.95
TPSA43.53 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.06
LogP ≤ 50.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-propan-2-yl-4H-imidazol-1-id-5-one;rhodium?
The IUPAC name of 2-propan-2-yl-4H-imidazol-1-id-5-one;rhodium (CID 59872601) is 2-propan-2-yl-4H-imidazol-1-id-5-one;rhodium.
What is the SMILES notation for 2-propan-2-yl-4H-imidazol-1-id-5-one;rhodium?
The canonical SMILES for 2-propan-2-yl-4H-imidazol-1-id-5-one;rhodium is CC(C)C1=NCC(=O)[N-]1.[Rh].
What is the InChIKey of 2-propan-2-yl-4H-imidazol-1-id-5-one;rhodium?
The InChIKey is ZHRFHOUBZNEGPS-UHFFFAOYSA-M. The full InChI is InChI=1S/C6H10N2O.Rh/c1-4(2)6-7-3-5(9)8-6;/h4H,3H2,1-2H3,(H,7,8,9);/p-1.
What are the key properties of 2-propan-2-yl-4H-imidazol-1-id-5-one;rhodium?
2-propan-2-yl-4H-imidazol-1-id-5-one;rhodium has a molecular weight of 228.06 g/mol, XLogP of 0.95, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propan-2-yl-4H-imidazol-1-id-5-one;rhodium is sourced from PubChem (CID 59872601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).