ethane;propane;1-(pyrrolidin-2-ylmethyl)pyrrolidine

C14H32N2 — CID 143192100

IUPACethane;propane;1-(pyrrolidin-2-ylmethyl)pyrrolidine
SMILESC1CNC(CN2CCCC2)C1.CC.CCC
InChIInChI=1S/C9H18N2.C3H8.C2H6/c1-2-7-11(6-1)8-9-4-3-5-10-9;1-3-2;1-2/h9-10H,1-8H2;3H2,1-2H3;1-2H3
InChIKeyYMIJHKACTYCGKS-UHFFFAOYSA-N
MW228.42 g/mol
LogP3.28
Rot. Bonds2

About ethane;propane;1-(pyrrolidin-2-ylmethyl)pyrrolidine

ethane;propane;1-(pyrrolidin-2-ylmethyl)pyrrolidine (PubChem CID 143192100) has the molecular formula C14H32N2 and a molecular weight of 228.42 g/mol. Its IUPAC name is ethane;propane;1-(pyrrolidin-2-ylmethyl)pyrrolidine.

Molecular Properties

Compound Nameethane;propane;1-(pyrrolidin-2-ylmethyl)pyrrolidine
PubChem CID143192100
Molecular FormulaC14H32N2
Molecular Weight228.42 g/mol
Exact Mass228.26
IUPAC Nameethane;propane;1-(pyrrolidin-2-ylmethyl)pyrrolidine
SMILESC1CNC(CN2CCCC2)C1.CC.CCC
InChIInChI=1S/C9H18N2.C3H8.C2H6/c1-2-7-11(6-1)8-9-4-3-5-10-9;1-3-2;1-2/h9-10H,1-8H2;3H2,1-2H3;1-2H3
InChIKeyYMIJHKACTYCGKS-UHFFFAOYSA-N
XLogP3.28
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.42
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-propan-2-yl-1-[[(2R)-pyrrolidin-2-yl]methyl]piperidine
CID 103495902
1-(pyrrolidin-2-ylmethyl)piperazine
CID 53406264
4-tert-butyl-1-[[(2S)-pyrrolidin-2-yl]methyl]azepane
CID 104870241
4-[[(2S)-pyrrolidin-2-yl]methyl]morpholine;dihydrochloride
CID 122361110
4-methyl-1-[[(2S)-piperidin-2-yl]methyl]piperidine
CID 7141723
[1-[[(2S)-pyrrolidin-2-yl]methyl]piperidin-4-yl]methanamine
CID 130690026
1-(azepan-2-ylmethyl)-4-methylazepane
CID 64570778
3,3-difluoro-1-(pyrrolidin-2-ylmethyl)piperidine
CID 115023488
1-(pyrrolidin-2-ylmethyl)azepan-4-one
CID 115020782
3-propan-2-yl-1-[[(2R)-pyrrolidin-2-yl]methyl]pyrrolidine
CID 102819669
4-(methoxymethyl)-1-(pyrrolidin-2-ylmethyl)piperidine
CID 63971924
1-cyclohexyl-4-[[(2S)-pyrrolidin-2-yl]methyl]piperazine
CID 126542421

Frequently Asked Questions

What is the IUPAC name of ethane;propane;1-(pyrrolidin-2-ylmethyl)pyrrolidine?
The IUPAC name of ethane;propane;1-(pyrrolidin-2-ylmethyl)pyrrolidine (CID 143192100) is ethane;propane;1-(pyrrolidin-2-ylmethyl)pyrrolidine.
What is the SMILES notation for ethane;propane;1-(pyrrolidin-2-ylmethyl)pyrrolidine?
The canonical SMILES for ethane;propane;1-(pyrrolidin-2-ylmethyl)pyrrolidine is C1CNC(CN2CCCC2)C1.CC.CCC.
What is the InChIKey of ethane;propane;1-(pyrrolidin-2-ylmethyl)pyrrolidine?
The InChIKey is YMIJHKACTYCGKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2.C3H8.C2H6/c1-2-7-11(6-1)8-9-4-3-5-10-9;1-3-2;1-2/h9-10H,1-8H2;3H2,1-2H3;1-2H3.
What are the key properties of ethane;propane;1-(pyrrolidin-2-ylmethyl)pyrrolidine?
ethane;propane;1-(pyrrolidin-2-ylmethyl)pyrrolidine has a molecular weight of 228.42 g/mol, XLogP of 3.28, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;propane;1-(pyrrolidin-2-ylmethyl)pyrrolidine is sourced from PubChem (CID 143192100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).