3-methylpyrazolidine

C4H10N2 — CID 14556720

IUPAC3-methylpyrazolidine
SMILESCC1CCNN1
InChIInChI=1S/C4H10N2/c1-4-2-3-5-6-4/h4-6H,2-3H2,1H3
InChIKeyZZIXNGRDILYTIK-UHFFFAOYSA-N
MW86.14 g/mol
LogP-0.13
Rot. Bonds

About 3-methylpyrazolidine

3-methylpyrazolidine (PubChem CID 14556720) has the molecular formula C4H10N2 and a molecular weight of 86.14 g/mol. Its IUPAC name is 3-methylpyrazolidine.

Molecular Properties

Compound Name3-methylpyrazolidine
PubChem CID14556720
Molecular FormulaC4H10N2
Molecular Weight86.14 g/mol
Exact Mass86.08
IUPAC Name3-methylpyrazolidine
SMILESCC1CCNN1
InChIInChI=1S/C4H10N2/c1-4-2-3-5-6-4/h4-6H,2-3H2,1H3
InChIKeyZZIXNGRDILYTIK-UHFFFAOYSA-N
XLogP-0.13
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50086.14
LogP ≤ 5-0.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-methylpyrazolidine?
The IUPAC name of 3-methylpyrazolidine (CID 14556720) is 3-methylpyrazolidine.
What is the SMILES notation for 3-methylpyrazolidine?
The canonical SMILES for 3-methylpyrazolidine is CC1CCNN1.
What is the InChIKey of 3-methylpyrazolidine?
The InChIKey is ZZIXNGRDILYTIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10N2/c1-4-2-3-5-6-4/h4-6H,2-3H2,1H3.
What are the key properties of 3-methylpyrazolidine?
3-methylpyrazolidine has a molecular weight of 86.14 g/mol, XLogP of -0.13, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methylpyrazolidine is sourced from PubChem (CID 14556720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).