1-(cyclohexen-1-yl)pyrrolidine;dihydrofluoride

C10H19F2N — CID 157446391

IUPAC1-(cyclohexen-1-yl)pyrrolidine;dihydrofluoride
SMILESC1=C(N2CCCC2)CCCC1.F.F
InChIInChI=1S/C10H17N.2FH/c1-2-6-10(7-3-1)11-8-4-5-9-11;;/h6H,1-5,7-9H2;2*1H
InChIKeyBSGSYWYWUAMZAT-UHFFFAOYSA-N
MW191.26 g/mol
LogP2.85
Rot. Bonds1

About 1-(cyclohexen-1-yl)pyrrolidine;dihydrofluoride

1-(cyclohexen-1-yl)pyrrolidine;dihydrofluoride (PubChem CID 157446391) has the molecular formula C10H19F2N and a molecular weight of 191.26 g/mol. Its IUPAC name is 1-(cyclohexen-1-yl)pyrrolidine;dihydrofluoride.

Molecular Properties

Compound Name1-(cyclohexen-1-yl)pyrrolidine;dihydrofluoride
PubChem CID157446391
Molecular FormulaC10H19F2N
Molecular Weight191.26 g/mol
Exact Mass191.15
IUPAC Name1-(cyclohexen-1-yl)pyrrolidine;dihydrofluoride
SMILESC1=C(N2CCCC2)CCCC1.F.F
InChIInChI=1S/C10H17N.2FH/c1-2-6-10(7-3-1)11-8-4-5-9-11;;/h6H,1-5,7-9H2;2*1H
InChIKeyBSGSYWYWUAMZAT-UHFFFAOYSA-N
XLogP2.85
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.26
LogP ≤ 52.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(cyclohexen-1-yl)pyrrolidine;dihydrofluoride?
The IUPAC name of 1-(cyclohexen-1-yl)pyrrolidine;dihydrofluoride (CID 157446391) is 1-(cyclohexen-1-yl)pyrrolidine;dihydrofluoride.
What is the SMILES notation for 1-(cyclohexen-1-yl)pyrrolidine;dihydrofluoride?
The canonical SMILES for 1-(cyclohexen-1-yl)pyrrolidine;dihydrofluoride is C1=C(N2CCCC2)CCCC1.F.F.
What is the InChIKey of 1-(cyclohexen-1-yl)pyrrolidine;dihydrofluoride?
The InChIKey is BSGSYWYWUAMZAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N.2FH/c1-2-6-10(7-3-1)11-8-4-5-9-11;;/h6H,1-5,7-9H2;2*1H.
What are the key properties of 1-(cyclohexen-1-yl)pyrrolidine;dihydrofluoride?
1-(cyclohexen-1-yl)pyrrolidine;dihydrofluoride has a molecular weight of 191.26 g/mol, XLogP of 2.85, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclohexen-1-yl)pyrrolidine;dihydrofluoride is sourced from PubChem (CID 157446391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).