(2R)-1-(3-fluoropropyl)-2-methylpiperazine

C8H17FN2 — CID 82761622

IUPAC(2R)-1-(3-fluoropropyl)-2-methylpiperazine
SMILESC[C@@H]1CNCCN1CCCF
InChIInChI=1S/C8H17FN2/c1-8-7-10-4-6-11(8)5-2-3-9/h8,10H,2-7H2,1H3/t8-/m1/s1
InChIKeyLBESSKCXOBVZKI-MRVPVSSYSA-N
MW160.24 g/mol
LogP0.64
Rot. Bonds3

About (2R)-1-(3-fluoropropyl)-2-methylpiperazine

(2R)-1-(3-fluoropropyl)-2-methylpiperazine (PubChem CID 82761622) has the molecular formula C8H17FN2 and a molecular weight of 160.24 g/mol. Its IUPAC name is (2R)-1-(3-fluoropropyl)-2-methylpiperazine.

Molecular Properties

Compound Name(2R)-1-(3-fluoropropyl)-2-methylpiperazine
PubChem CID82761622
Molecular FormulaC8H17FN2
Molecular Weight160.24 g/mol
Exact Mass160.14
IUPAC Name(2R)-1-(3-fluoropropyl)-2-methylpiperazine
SMILESC[C@@H]1CNCCN1CCCF
InChIInChI=1S/C8H17FN2/c1-8-7-10-4-6-11(8)5-2-3-9/h8,10H,2-7H2,1H3/t8-/m1/s1
InChIKeyLBESSKCXOBVZKI-MRVPVSSYSA-N
XLogP0.64
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.24
LogP ≤ 50.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-1-(2-fluoroethyl)-2-methylpiperazine
CID 82761196
(2S)-2-methyl-1-(4,4,4-trifluorobutyl)piperazine
CID 82756199
(2R)-1-dodecyl-2-methylpiperazine
CID 82761023
2-methyl-1-(4-methylpentyl)piperazine
CID 64931123
1-(3-methoxypropyl)-2-methylpiperazine
CID 62674205
2-methyl-1-(3,3,3-trifluoropropyl)piperazine
CID 64565894
methanol;2-methyl-1-nonylpiperazine
CID 144711987
(2R)-1-(2-ethylsulfanylethyl)-2-methylpiperazine
CID 103866008
7-(2-methylpiperazin-1-yl)heptanenitrile
CID 50999683
2-methyl-1-(4-propan-2-yloxybutyl)piperazine
CID 106008832
1-[3-(2-methoxyethoxy)propyl]-2-methylpiperazine
CID 103410154
1-[3-(4-fluorophenoxy)propyl]-2-methylpiperazine
CID 50999666

Frequently Asked Questions

What is the IUPAC name of (2R)-1-(3-fluoropropyl)-2-methylpiperazine?
The IUPAC name of (2R)-1-(3-fluoropropyl)-2-methylpiperazine (CID 82761622) is (2R)-1-(3-fluoropropyl)-2-methylpiperazine.
What is the SMILES notation for (2R)-1-(3-fluoropropyl)-2-methylpiperazine?
The canonical SMILES for (2R)-1-(3-fluoropropyl)-2-methylpiperazine is C[C@@H]1CNCCN1CCCF.
What is the InChIKey of (2R)-1-(3-fluoropropyl)-2-methylpiperazine?
The InChIKey is LBESSKCXOBVZKI-MRVPVSSYSA-N. The full InChI is InChI=1S/C8H17FN2/c1-8-7-10-4-6-11(8)5-2-3-9/h8,10H,2-7H2,1H3/t8-/m1/s1.
What are the key properties of (2R)-1-(3-fluoropropyl)-2-methylpiperazine?
(2R)-1-(3-fluoropropyl)-2-methylpiperazine has a molecular weight of 160.24 g/mol, XLogP of 0.64, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-(3-fluoropropyl)-2-methylpiperazine is sourced from PubChem (CID 82761622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).