(2S)-1-methyl-2-[(3R)-1-methylpyrrolidin-3-yl]pyrrolidine

C10H20N2 — CID 162982738

IUPAC(2S)-1-methyl-2-[(3R)-1-methylpyrrolidin-3-yl]pyrrolidine
SMILESCN1CC[C@@H]([C@@H]2CCCN2C)C1
InChIInChI=1S/C10H20N2/c1-11-7-5-9(8-11)10-4-3-6-12(10)2/h9-10H,3-8H2,1-2H3/t9-,10+/m1/s1
InChIKeyLGGCPJTUUHWHRJ-ZJUUUORDSA-N
MW168.28 g/mol
LogP1.03
Rot. Bonds1

About (2S)-1-methyl-2-[(3R)-1-methylpyrrolidin-3-yl]pyrrolidine

(2S)-1-methyl-2-[(3R)-1-methylpyrrolidin-3-yl]pyrrolidine (PubChem CID 162982738) has the molecular formula C10H20N2 and a molecular weight of 168.28 g/mol. Its IUPAC name is (2S)-1-methyl-2-[(3R)-1-methylpyrrolidin-3-yl]pyrrolidine.

Molecular Properties

Compound Name(2S)-1-methyl-2-[(3R)-1-methylpyrrolidin-3-yl]pyrrolidine
PubChem CID162982738
Molecular FormulaC10H20N2
Molecular Weight168.28 g/mol
Exact Mass168.16
IUPAC Name(2S)-1-methyl-2-[(3R)-1-methylpyrrolidin-3-yl]pyrrolidine
SMILESCN1CC[C@@H]([C@@H]2CCCN2C)C1
InChIInChI=1S/C10H20N2/c1-11-7-5-9(8-11)10-4-3-6-12(10)2/h9-10H,3-8H2,1-2H3/t9-,10+/m1/s1
InChIKeyLGGCPJTUUHWHRJ-ZJUUUORDSA-N
XLogP1.03
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 51.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Heliotridane
CID 11094614
1-Methylhexahydro-1H-pyrrolizine
CID 15559671
rel-(1R,7aS)-1-methylhexahydro-1H-pyrrolizine
CID 639426
(1R,8R)-1-methyl-2,3,5,6,7,8-hexahydro-1H-pyrrolizine
CID 11643928
(1S,7AR)-1-methylhexahydro-1H-pyrrolizine
CID 11815356
(1S,8R)-1-(deuteriomethyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizine
CID 135059859
1-Methyl-2-(1-methylpyrrolidin-3-yl)pyrrolidine
CID 58400596
1-Methyl-2-pyrrolidin-3-ylpyrrolidine
CID 82416480
(2R)-2-(fluoromethyl)-4-[5-(fluoromethyl)-1-methylpyrrolidin-3-yl]-1-methylpyrrolidine
CID 91805705
3-Fluoro-1-[1-(1-methylpyrrolidin-3-yl)propan-2-yl]pyrrolidine
CID 123743172
(2S)-1-methyl-2-(trifluoromethyl)-4-[2-[(2R)-2-(trifluoromethyl)pyrrolidin-1-yl]propyl]pyrrolidine
CID 126614740
1-Tert-butyl-3-[2-(3-fluoropyrrolidin-1-yl)-2-methylpropyl]-2,5-dimethylpyrrolidine
CID 138562974

Frequently Asked Questions

What is the IUPAC name of (2S)-1-methyl-2-[(3R)-1-methylpyrrolidin-3-yl]pyrrolidine?
The IUPAC name of (2S)-1-methyl-2-[(3R)-1-methylpyrrolidin-3-yl]pyrrolidine (CID 162982738) is (2S)-1-methyl-2-[(3R)-1-methylpyrrolidin-3-yl]pyrrolidine.
What is the SMILES notation for (2S)-1-methyl-2-[(3R)-1-methylpyrrolidin-3-yl]pyrrolidine?
The canonical SMILES for (2S)-1-methyl-2-[(3R)-1-methylpyrrolidin-3-yl]pyrrolidine is CN1CC[C@@H]([C@@H]2CCCN2C)C1.
What is the InChIKey of (2S)-1-methyl-2-[(3R)-1-methylpyrrolidin-3-yl]pyrrolidine?
The InChIKey is LGGCPJTUUHWHRJ-ZJUUUORDSA-N. The full InChI is InChI=1S/C10H20N2/c1-11-7-5-9(8-11)10-4-3-6-12(10)2/h9-10H,3-8H2,1-2H3/t9-,10+/m1/s1.
What are the key properties of (2S)-1-methyl-2-[(3R)-1-methylpyrrolidin-3-yl]pyrrolidine?
(2S)-1-methyl-2-[(3R)-1-methylpyrrolidin-3-yl]pyrrolidine has a molecular weight of 168.28 g/mol, XLogP of 1.03, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-1-methyl-2-[(3R)-1-methylpyrrolidin-3-yl]pyrrolidine is sourced from PubChem (CID 162982738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).