2,4-dimethylpyrrolidine

C6H13N — CID 10887841

IUPAC2,4-dimethylpyrrolidine
SMILESCC1CNC(C)C1
InChIInChI=1S/C6H13N/c1-5-3-6(2)7-4-5/h5-7H,3-4H2,1-2H3
InChIKeyDUOJVRWFIHNZTJ-UHFFFAOYSA-N
MW99.18 g/mol
LogP1.00
Rot. Bonds

About 2,4-dimethylpyrrolidine

2,4-dimethylpyrrolidine (PubChem CID 10887841) has the molecular formula C6H13N and a molecular weight of 99.18 g/mol. Its IUPAC name is 2,4-dimethylpyrrolidine.

Molecular Properties

Compound Name2,4-dimethylpyrrolidine
PubChem CID10887841
Molecular FormulaC6H13N
Molecular Weight99.18 g/mol
Exact Mass99.10
IUPAC Name2,4-dimethylpyrrolidine
SMILESCC1CNC(C)C1
InChIInChI=1S/C6H13N/c1-5-3-6(2)7-4-5/h5-7H,3-4H2,1-2H3
InChIKeyDUOJVRWFIHNZTJ-UHFFFAOYSA-N
XLogP1.00
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50099.18
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,4-dimethylpyrrolidine?
The IUPAC name of 2,4-dimethylpyrrolidine (CID 10887841) is 2,4-dimethylpyrrolidine.
What is the SMILES notation for 2,4-dimethylpyrrolidine?
The canonical SMILES for 2,4-dimethylpyrrolidine is CC1CNC(C)C1.
What is the InChIKey of 2,4-dimethylpyrrolidine?
The InChIKey is DUOJVRWFIHNZTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13N/c1-5-3-6(2)7-4-5/h5-7H,3-4H2,1-2H3.
What are the key properties of 2,4-dimethylpyrrolidine?
2,4-dimethylpyrrolidine has a molecular weight of 99.18 g/mol, XLogP of 1.00, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethylpyrrolidine is sourced from PubChem (CID 10887841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).