1,5-dimethylpyrazolidine

C5H12N2 — CID 44558449

IUPAC1,5-dimethylpyrazolidine
SMILESCC1CCNN1C
InChIInChI=1S/C5H12N2/c1-5-3-4-6-7(5)2/h5-6H,3-4H2,1-2H3
InChIKeyGNGKVENPULVDDB-UHFFFAOYSA-N
MW100.17 g/mol
LogP0.22
Rot. Bonds

About 1,5-dimethylpyrazolidine

1,5-dimethylpyrazolidine (PubChem CID 44558449) has the molecular formula C5H12N2 and a molecular weight of 100.17 g/mol. Its IUPAC name is 1,5-dimethylpyrazolidine.

Molecular Properties

Compound Name1,5-dimethylpyrazolidine
PubChem CID44558449
Molecular FormulaC5H12N2
Molecular Weight100.17 g/mol
Exact Mass100.10
IUPAC Name1,5-dimethylpyrazolidine
SMILESCC1CCNN1C
InChIInChI=1S/C5H12N2/c1-5-3-4-6-7(5)2/h5-6H,3-4H2,1-2H3
InChIKeyGNGKVENPULVDDB-UHFFFAOYSA-N
XLogP0.22
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500100.17
LogP ≤ 50.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,5-dimethylpyrazolidine?
The IUPAC name of 1,5-dimethylpyrazolidine (CID 44558449) is 1,5-dimethylpyrazolidine.
What is the SMILES notation for 1,5-dimethylpyrazolidine?
The canonical SMILES for 1,5-dimethylpyrazolidine is CC1CCNN1C.
What is the InChIKey of 1,5-dimethylpyrazolidine?
The InChIKey is GNGKVENPULVDDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12N2/c1-5-3-4-6-7(5)2/h5-6H,3-4H2,1-2H3.
What are the key properties of 1,5-dimethylpyrazolidine?
1,5-dimethylpyrazolidine has a molecular weight of 100.17 g/mol, XLogP of 0.22, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dimethylpyrazolidine is sourced from PubChem (CID 44558449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).