2,5-dimethylpyrrolidine;2,2,5,5-tetramethylpyrrolidine

C14H30N2 — CID 68883231

IUPAC2,5-dimethylpyrrolidine;2,2,5,5-tetramethylpyrrolidine
SMILESCC1(C)CCC(C)(C)N1.CC1CCC(C)N1
InChIInChI=1S/C8H17N.C6H13N/c1-7(2)5-6-8(3,4)9-7;1-5-3-4-6(2)7-5/h9H,5-6H2,1-4H3;5-7H,3-4H2,1-2H3
InChIKeyWMYWPYRCFKDQCM-UHFFFAOYSA-N
MW226.41 g/mol
LogP3.07
Rot. Bonds

About 2,5-dimethylpyrrolidine;2,2,5,5-tetramethylpyrrolidine

2,5-dimethylpyrrolidine;2,2,5,5-tetramethylpyrrolidine (PubChem CID 68883231) has the molecular formula C14H30N2 and a molecular weight of 226.41 g/mol. Its IUPAC name is 2,5-dimethylpyrrolidine;2,2,5,5-tetramethylpyrrolidine.

Molecular Properties

Compound Name2,5-dimethylpyrrolidine;2,2,5,5-tetramethylpyrrolidine
PubChem CID68883231
Molecular FormulaC14H30N2
Molecular Weight226.41 g/mol
Exact Mass226.24
IUPAC Name2,5-dimethylpyrrolidine;2,2,5,5-tetramethylpyrrolidine
SMILESCC1(C)CCC(C)(C)N1.CC1CCC(C)N1
InChIInChI=1S/C8H17N.C6H13N/c1-7(2)5-6-8(3,4)9-7;1-5-3-4-6(2)7-5/h9H,5-6H2,1-4H3;5-7H,3-4H2,1-2H3
InChIKeyWMYWPYRCFKDQCM-UHFFFAOYSA-N
XLogP3.07
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.41
LogP ≤ 53.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,5-dimethylpyrrolidine;2,2,5,5-tetramethylpyrrolidine?
The IUPAC name of 2,5-dimethylpyrrolidine;2,2,5,5-tetramethylpyrrolidine (CID 68883231) is 2,5-dimethylpyrrolidine;2,2,5,5-tetramethylpyrrolidine.
What is the SMILES notation for 2,5-dimethylpyrrolidine;2,2,5,5-tetramethylpyrrolidine?
The canonical SMILES for 2,5-dimethylpyrrolidine;2,2,5,5-tetramethylpyrrolidine is CC1(C)CCC(C)(C)N1.CC1CCC(C)N1.
What is the InChIKey of 2,5-dimethylpyrrolidine;2,2,5,5-tetramethylpyrrolidine?
The InChIKey is WMYWPYRCFKDQCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N.C6H13N/c1-7(2)5-6-8(3,4)9-7;1-5-3-4-6(2)7-5/h9H,5-6H2,1-4H3;5-7H,3-4H2,1-2H3.
What are the key properties of 2,5-dimethylpyrrolidine;2,2,5,5-tetramethylpyrrolidine?
2,5-dimethylpyrrolidine;2,2,5,5-tetramethylpyrrolidine has a molecular weight of 226.41 g/mol, XLogP of 3.07, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethylpyrrolidine;2,2,5,5-tetramethylpyrrolidine is sourced from PubChem (CID 68883231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).