1-(cyclohexen-1-yl)pyrrolidine;1-(cyclopenten-1-yl)pyrrolidine;methane

C20H36N2 — CID 158056364

IUPAC1-(cyclohexen-1-yl)pyrrolidine;1-(cyclopenten-1-yl)pyrrolidine;methane
SMILESC.C1=C(N2CCCC2)CCC1.C1=C(N2CCCC2)CCCC1
InChIInChI=1S/C10H17N.C9H15N.CH4/c1-2-6-10(7-3-1)11-8-4-5-9-11;1-2-6-9(5-1)10-7-3-4-8-10;/h6H,1-5,7-9H2;5H,1-4,6-8H2;1H4
InChIKeyFKCIAKWIUNOHEM-UHFFFAOYSA-N
MW304.52 g/mol
LogP5.33
Rot. Bonds2

About 1-(cyclohexen-1-yl)pyrrolidine;1-(cyclopenten-1-yl)pyrrolidine;methane

1-(cyclohexen-1-yl)pyrrolidine;1-(cyclopenten-1-yl)pyrrolidine;methane (PubChem CID 158056364) has the molecular formula C20H36N2 and a molecular weight of 304.52 g/mol. Its IUPAC name is 1-(cyclohexen-1-yl)pyrrolidine;1-(cyclopenten-1-yl)pyrrolidine;methane.

Molecular Properties

Compound Name1-(cyclohexen-1-yl)pyrrolidine;1-(cyclopenten-1-yl)pyrrolidine;methane
PubChem CID158056364
Molecular FormulaC20H36N2
Molecular Weight304.52 g/mol
Exact Mass304.29
IUPAC Name1-(cyclohexen-1-yl)pyrrolidine;1-(cyclopenten-1-yl)pyrrolidine;methane
SMILESC.C1=C(N2CCCC2)CCC1.C1=C(N2CCCC2)CCCC1
InChIInChI=1S/C10H17N.C9H15N.CH4/c1-2-6-10(7-3-1)11-8-4-5-9-11;1-2-6-9(5-1)10-7-3-4-8-10;/h6H,1-5,7-9H2;5H,1-4,6-8H2;1H4
InChIKeyFKCIAKWIUNOHEM-UHFFFAOYSA-N
XLogP5.33
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500304.52
LogP ≤ 55.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Tributyl-(3-pyrrolidin-1-ylcyclohex-2-en-1-yl)stannane
CID 14250104
Tributyl-(3-pyrrolidin-1-ylcyclopent-2-en-1-yl)stannane
CID 14250112
1-(6-Pyrrolidin-1-yl-1-cyclohexenyl)-pyrrolidine
CID 14315943
7-Pyrrolidin-1-yl-1,2,3,5,8,8a-hexahydroindolizine
CID 15275033
1-(Cyclohexen-1-yl)-1-methylpyrrolidin-1-ium
CID 58070566
1-(Cyclohexen-1-yl)-3-(pyrrolidin-1-ylmethyl)pyrrolidine
CID 123774253
1-(Cyclohexen-1-yl)pyrrolidine;ethane
CID 144378140
1-(Cyclohexen-1-yl)pyrrolidine;propane;pyrrolidine
CID 144821755
1-(Cyclohexen-1-yl)pyrrolidine;1-(cyclopenten-1-yl)pyrrolidine
CID 157996565
8-Methyl-3-pyrrolidin-1-yl-8-azabicyclo[3.2.1]oct-2-ene
CID 119054149
(1R,5R)-8-methyl-3-pyrrolidin-1-yl-8-azabicyclo[3.2.1]oct-2-ene
CID 124745234

Frequently Asked Questions

What is the IUPAC name of 1-(cyclohexen-1-yl)pyrrolidine;1-(cyclopenten-1-yl)pyrrolidine;methane?
The IUPAC name of 1-(cyclohexen-1-yl)pyrrolidine;1-(cyclopenten-1-yl)pyrrolidine;methane (CID 158056364) is 1-(cyclohexen-1-yl)pyrrolidine;1-(cyclopenten-1-yl)pyrrolidine;methane.
What is the SMILES notation for 1-(cyclohexen-1-yl)pyrrolidine;1-(cyclopenten-1-yl)pyrrolidine;methane?
The canonical SMILES for 1-(cyclohexen-1-yl)pyrrolidine;1-(cyclopenten-1-yl)pyrrolidine;methane is C.C1=C(N2CCCC2)CCC1.C1=C(N2CCCC2)CCCC1.
What is the InChIKey of 1-(cyclohexen-1-yl)pyrrolidine;1-(cyclopenten-1-yl)pyrrolidine;methane?
The InChIKey is FKCIAKWIUNOHEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N.C9H15N.CH4/c1-2-6-10(7-3-1)11-8-4-5-9-11;1-2-6-9(5-1)10-7-3-4-8-10;/h6H,1-5,7-9H2;5H,1-4,6-8H2;1H4.
What are the key properties of 1-(cyclohexen-1-yl)pyrrolidine;1-(cyclopenten-1-yl)pyrrolidine;methane?
1-(cyclohexen-1-yl)pyrrolidine;1-(cyclopenten-1-yl)pyrrolidine;methane has a molecular weight of 304.52 g/mol, XLogP of 5.33, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclohexen-1-yl)pyrrolidine;1-(cyclopenten-1-yl)pyrrolidine;methane is sourced from PubChem (CID 158056364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).