(2R,5R)-2,5-dimethylpyrrolidine

C6H13N — CID 641767

IUPAC(2R,5R)-2,5-dimethylpyrrolidine
SMILESC[C@@H]1CC[C@@H](C)N1
InChIInChI=1S/C6H13N/c1-5-3-4-6(2)7-5/h5-7H,3-4H2,1-2H3/t5-,6-/m1/s1
InChIKeyZEBFPAXSQXIPNF-PHDIDXHHSA-N
MW99.18 g/mol
LogP1.15
Rot. Bonds

About (2R,5R)-2,5-dimethylpyrrolidine

(2R,5R)-2,5-dimethylpyrrolidine (PubChem CID 641767) has the molecular formula C6H13N and a molecular weight of 99.18 g/mol. Its IUPAC name is (2R,5R)-2,5-dimethylpyrrolidine.

Molecular Properties

Compound Name(2R,5R)-2,5-dimethylpyrrolidine
PubChem CID641767
Molecular FormulaC6H13N
Molecular Weight99.18 g/mol
Exact Mass99.10
IUPAC Name(2R,5R)-2,5-dimethylpyrrolidine
SMILESC[C@@H]1CC[C@@H](C)N1
InChIInChI=1S/C6H13N/c1-5-3-4-6(2)7-5/h5-7H,3-4H2,1-2H3/t5-,6-/m1/s1
InChIKeyZEBFPAXSQXIPNF-PHDIDXHHSA-N
XLogP1.15
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 ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(R)-2-Methylpyrrolidine
CID 641544
2-Methylpyrrolidine
CID 13003
(S)-(+)-2-(Aminomethyl)pyrrolidine
CID 2734054
2-(2-Aminoethyl)-1-methylpyrrolidine
CID 98388
2,5-Dimethylpyrrolidine
CID 96034
N-Ethylcyclopentanamine
CID 558581
2,2,5-Trimethylpyrrolidine
CID 21572701
2-Propylpyrrolidine
CID 3795961
(2S)-2-methylpyrrolidine
CID 6999702
cis-2,5-Dimethylpyrrolidine
CID 5324511
Pyrrolidine, 2-butyl-5-heptyl-, (2R,5R)-rel-
CID 156256
2-Butyl-5-heptylpyrrolidine
CID 581131

Frequently Asked Questions

What is the IUPAC name of (2R,5R)-2,5-dimethylpyrrolidine?
The IUPAC name of (2R,5R)-2,5-dimethylpyrrolidine (CID 641767) is (2R,5R)-2,5-dimethylpyrrolidine.
What is the SMILES notation for (2R,5R)-2,5-dimethylpyrrolidine?
The canonical SMILES for (2R,5R)-2,5-dimethylpyrrolidine is C[C@@H]1CC[C@@H](C)N1.
What is the InChIKey of (2R,5R)-2,5-dimethylpyrrolidine?
The InChIKey is ZEBFPAXSQXIPNF-PHDIDXHHSA-N. The full InChI is InChI=1S/C6H13N/c1-5-3-4-6(2)7-5/h5-7H,3-4H2,1-2H3/t5-,6-/m1/s1.
What are the key properties of (2R,5R)-2,5-dimethylpyrrolidine?
(2R,5R)-2,5-dimethylpyrrolidine has a molecular weight of 99.18 g/mol, XLogP of 1.15, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,5R)-2,5-dimethylpyrrolidine is sourced from PubChem (CID 641767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).