molecular hydrogen;3-propan-2-ylpyrrolidine;hydrofluoride

C7H18FN — CID 168909701

IUPACmolecular hydrogen;3-propan-2-ylpyrrolidine;hydrofluoride
SMILESCC(C)C1CCNC1.F.[H][H]
InChIInChI=1S/C7H15N.FH.H2/c1-6(2)7-3-4-8-5-7;;/h6-8H,3-5H2,1-2H3;2*1H
InChIKeyLEAXDPJESFKLHL-UHFFFAOYSA-N
MW135.23 g/mol
LogP1.65
Rot. Bonds1

About molecular hydrogen;3-propan-2-ylpyrrolidine;hydrofluoride

molecular hydrogen;3-propan-2-ylpyrrolidine;hydrofluoride (PubChem CID 168909701) has the molecular formula C7H18FN and a molecular weight of 135.23 g/mol. Its IUPAC name is molecular hydrogen;3-propan-2-ylpyrrolidine;hydrofluoride.

Molecular Properties

Compound Namemolecular hydrogen;3-propan-2-ylpyrrolidine;hydrofluoride
PubChem CID168909701
Molecular FormulaC7H18FN
Molecular Weight135.23 g/mol
Exact Mass135.14
IUPAC Namemolecular hydrogen;3-propan-2-ylpyrrolidine;hydrofluoride
SMILESCC(C)C1CCNC1.F.[H][H]
InChIInChI=1S/C7H15N.FH.H2/c1-6(2)7-3-4-8-5-7;;/h6-8H,3-5H2,1-2H3;2*1H
InChIKeyLEAXDPJESFKLHL-UHFFFAOYSA-N
XLogP1.65
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.23
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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(1R)-N-methyl-1-[(3S)-pyrrolidin-3-yl]ethanamine
CID 15223500
ethane;3-methyl-4-propan-2-yloxane;3-propan-2-ylpiperidine;3-propan-2-ylpyrrolidine
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CID 164599271
3-(2,2,4,4-tetramethylpentan-3-yl)pyrrolidine
CID 146228066
(1S)-N-ethyl-1-[(3S)-pyrrolidin-3-yl]ethanamine
CID 10034728
3-methyl-1-pyrrolidin-3-ylbutan-1-amine
CID 82416019
3-methyl-1-pyrrolidin-3-ylbutan-1-ol
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(3S)-3-[(1R)-1-azidoethyl]pyrrolidine
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ethane;N-ethyl-1-pyrrolidin-3-ylethanamine;propane
CID 143400696

Frequently Asked Questions

What is the IUPAC name of molecular hydrogen;3-propan-2-ylpyrrolidine;hydrofluoride?
The IUPAC name of molecular hydrogen;3-propan-2-ylpyrrolidine;hydrofluoride (CID 168909701) is molecular hydrogen;3-propan-2-ylpyrrolidine;hydrofluoride.
What is the SMILES notation for molecular hydrogen;3-propan-2-ylpyrrolidine;hydrofluoride?
The canonical SMILES for molecular hydrogen;3-propan-2-ylpyrrolidine;hydrofluoride is CC(C)C1CCNC1.F.[H][H].
What is the InChIKey of molecular hydrogen;3-propan-2-ylpyrrolidine;hydrofluoride?
The InChIKey is LEAXDPJESFKLHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15N.FH.H2/c1-6(2)7-3-4-8-5-7;;/h6-8H,3-5H2,1-2H3;2*1H.
What are the key properties of molecular hydrogen;3-propan-2-ylpyrrolidine;hydrofluoride?
molecular hydrogen;3-propan-2-ylpyrrolidine;hydrofluoride has a molecular weight of 135.23 g/mol, XLogP of 1.65, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for molecular hydrogen;3-propan-2-ylpyrrolidine;hydrofluoride is sourced from PubChem (CID 168909701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).