1,3-dimethylpyrazolidine

C5H12N2 — CID 44558448

IUPAC1,3-dimethylpyrazolidine
SMILESCC1CCN(C)N1
InChIInChI=1S/C5H12N2/c1-5-3-4-7(2)6-5/h5-6H,3-4H2,1-2H3
InChIKeySEOATTXTBHDWEC-UHFFFAOYSA-N
MW100.17 g/mol
LogP0.22
Rot. Bonds

About 1,3-dimethylpyrazolidine

1,3-dimethylpyrazolidine (PubChem CID 44558448) has the molecular formula C5H12N2 and a molecular weight of 100.17 g/mol. Its IUPAC name is 1,3-dimethylpyrazolidine.

Molecular Properties

Compound Name1,3-dimethylpyrazolidine
PubChem CID44558448
Molecular FormulaC5H12N2
Molecular Weight100.17 g/mol
Exact Mass100.10
IUPAC Name1,3-dimethylpyrazolidine
SMILESCC1CCN(C)N1
InChIInChI=1S/C5H12N2/c1-5-3-4-7(2)6-5/h5-6H,3-4H2,1-2H3
InChIKeySEOATTXTBHDWEC-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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Related Compounds

Methylpyrazolidine
CID 12457930
1,4-Dimethylpyrazolidine
CID 12457931
1-Ethylpyrazolidine
CID 12612930
N-Methylpyrrolidin-1-amine
CID 19362293
Butylpyrazolidine
CID 19603994
1,2,4-Trimethyltriazolidine
CID 91135338
1-(Difluoromethyl)-3-methylpyrazolidine
CID 89130017
3-Methyl-1-(2,2,2-trifluoroethyl)pyrazolidine
CID 89130040
1,3-Dimethyl-5-(trifluoromethyl)pyrazolidine
CID 89687892
1-(Difluoromethyl)-3,5-dimethylpyrazolidine
CID 89687894
5-Methyl-1-(2,2,2-trifluoroethyl)pyrazolidine
CID 89687908
1-(2,2-Difluoroethyl)-3-methylpyrazolidine
CID 89995872

Frequently Asked Questions

What is the IUPAC name of 1,3-dimethylpyrazolidine?
The IUPAC name of 1,3-dimethylpyrazolidine (CID 44558448) is 1,3-dimethylpyrazolidine.
What is the SMILES notation for 1,3-dimethylpyrazolidine?
The canonical SMILES for 1,3-dimethylpyrazolidine is CC1CCN(C)N1.
What is the InChIKey of 1,3-dimethylpyrazolidine?
The InChIKey is SEOATTXTBHDWEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12N2/c1-5-3-4-7(2)6-5/h5-6H,3-4H2,1-2H3.
What are the key properties of 1,3-dimethylpyrazolidine?
1,3-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 1,3-dimethylpyrazolidine is sourced from PubChem (CID 44558448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).