(2S)-2-[[(3S)-3-fluoropyrrolidin-1-yl]methyl]piperidine

C10H19FN2 — CID 67692411

IUPAC(2S)-2-[[(3S)-3-fluoropyrrolidin-1-yl]methyl]piperidine
SMILESF[C@H]1CCN(C[C@@H]2CCCCN2)C1
InChIInChI=1S/C10H19FN2/c11-9-4-6-13(7-9)8-10-3-1-2-5-12-10/h9-10,12H,1-8H2/t9-,10-/m0/s1
InChIKeyKCERPRDFPWGQNX-UWVGGRQHSA-N
MW186.27 g/mol
LogP1.17
Rot. Bonds2

About (2S)-2-[[(3S)-3-fluoropyrrolidin-1-yl]methyl]piperidine

(2S)-2-[[(3S)-3-fluoropyrrolidin-1-yl]methyl]piperidine (PubChem CID 67692411) has the molecular formula C10H19FN2 and a molecular weight of 186.27 g/mol. Its IUPAC name is (2S)-2-[[(3S)-3-fluoropyrrolidin-1-yl]methyl]piperidine.

Molecular Properties

Compound Name(2S)-2-[[(3S)-3-fluoropyrrolidin-1-yl]methyl]piperidine
PubChem CID67692411
Molecular FormulaC10H19FN2
Molecular Weight186.27 g/mol
Exact Mass186.15
IUPAC Name(2S)-2-[[(3S)-3-fluoropyrrolidin-1-yl]methyl]piperidine
SMILESF[C@H]1CCN(C[C@@H]2CCCCN2)C1
InChIInChI=1S/C10H19FN2/c11-9-4-6-13(7-9)8-10-3-1-2-5-12-10/h9-10,12H,1-8H2/t9-,10-/m0/s1
InChIKeyKCERPRDFPWGQNX-UWVGGRQHSA-N
XLogP1.17
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.27
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(1-Pyrrolidinyl)piperidine
CID 78703
3-(Pyrrolidin-1-yl)piperidine
CID 573611
1-Cyclopentylpiperazine
CID 806421
1-(Pyrrolidin-3-yl)piperidine
CID 23009617
1-Methyloctahydropyrrolo(1,2-a)pyrazine
CID 44827712
N-(2-Piperidylmethyl)-dimethylamine
CID 252484
1-[(Pyrrolidin-2-yl)methyl]piperidine
CID 3973870
Methyl[(1-methylpiperidin-2-yl)methyl]amine
CID 10240913
N-(2-pyrrolidin-1-ylethyl)cyclohexanamine
CID 43181622
2-(2-Pyrrolidin-1-ylethyl)piperidine
CID 231871
2-Pyrrolidin-1-ylmethyl-piperidine
CID 2760541
dimethyl({[(2R)-piperidin-2-yl]methyl})amine
CID 6993259

Frequently Asked Questions

What is the IUPAC name of (2S)-2-[[(3S)-3-fluoropyrrolidin-1-yl]methyl]piperidine?
The IUPAC name of (2S)-2-[[(3S)-3-fluoropyrrolidin-1-yl]methyl]piperidine (CID 67692411) is (2S)-2-[[(3S)-3-fluoropyrrolidin-1-yl]methyl]piperidine.
What is the SMILES notation for (2S)-2-[[(3S)-3-fluoropyrrolidin-1-yl]methyl]piperidine?
The canonical SMILES for (2S)-2-[[(3S)-3-fluoropyrrolidin-1-yl]methyl]piperidine is F[C@H]1CCN(C[C@@H]2CCCCN2)C1.
What is the InChIKey of (2S)-2-[[(3S)-3-fluoropyrrolidin-1-yl]methyl]piperidine?
The InChIKey is KCERPRDFPWGQNX-UWVGGRQHSA-N. The full InChI is InChI=1S/C10H19FN2/c11-9-4-6-13(7-9)8-10-3-1-2-5-12-10/h9-10,12H,1-8H2/t9-,10-/m0/s1.
What are the key properties of (2S)-2-[[(3S)-3-fluoropyrrolidin-1-yl]methyl]piperidine?
(2S)-2-[[(3S)-3-fluoropyrrolidin-1-yl]methyl]piperidine has a molecular weight of 186.27 g/mol, XLogP of 1.17, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-[[(3S)-3-fluoropyrrolidin-1-yl]methyl]piperidine is sourced from PubChem (CID 67692411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).