chromium;1,3-dimethylpyrazole

C5H8CrN2 — CID 174318008

IUPACchromium;1,3-dimethylpyrazole
SMILESCc1ccn(C)n1.[Cr]
InChIInChI=1S/C5H8N2.Cr/c1-5-3-4-7(2)6-5;/h3-4H,1-2H3;
InChIKeyGQOPONNEEAZFLP-UHFFFAOYSA-N
MW148.13 g/mol
LogP0.73
Rot. Bonds

About chromium;1,3-dimethylpyrazole

chromium;1,3-dimethylpyrazole (PubChem CID 174318008) has the molecular formula C5H8CrN2 and a molecular weight of 148.13 g/mol. Its IUPAC name is chromium;1,3-dimethylpyrazole.

Molecular Properties

Compound Namechromium;1,3-dimethylpyrazole
PubChem CID174318008
Molecular FormulaC5H8CrN2
Molecular Weight148.13 g/mol
Exact Mass148.01
IUPAC Namechromium;1,3-dimethylpyrazole
SMILESCc1ccn(C)n1.[Cr]
InChIInChI=1S/C5H8N2.Cr/c1-5-3-4-7(2)6-5;/h3-4H,1-2H3;
InChIKeyGQOPONNEEAZFLP-UHFFFAOYSA-N
XLogP0.73
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.13
LogP ≤ 50.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of chromium;1,3-dimethylpyrazole?
The IUPAC name of chromium;1,3-dimethylpyrazole (CID 174318008) is chromium;1,3-dimethylpyrazole.
What is the SMILES notation for chromium;1,3-dimethylpyrazole?
The canonical SMILES for chromium;1,3-dimethylpyrazole is Cc1ccn(C)n1.[Cr].
What is the InChIKey of chromium;1,3-dimethylpyrazole?
The InChIKey is GQOPONNEEAZFLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N2.Cr/c1-5-3-4-7(2)6-5;/h3-4H,1-2H3;.
What are the key properties of chromium;1,3-dimethylpyrazole?
chromium;1,3-dimethylpyrazole has a molecular weight of 148.13 g/mol, XLogP of 0.73, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for chromium;1,3-dimethylpyrazole is sourced from PubChem (CID 174318008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).