1-[(1-fluorocyclopropyl)methyl]-2,5-dimethylpiperazine

C10H19FN2 — CID 130678882

IUPAC1-[(1-fluorocyclopropyl)methyl]-2,5-dimethylpiperazine
SMILESCC1CN(CC2(F)CC2)C(C)CN1
InChIInChI=1S/C10H19FN2/c1-8-6-13(9(2)5-12-8)7-10(11)3-4-10/h8-9,12H,3-7H2,1-2H3
InChIKeyWGHDRBMZEWXGRV-UHFFFAOYSA-N
MW186.27 g/mol
LogP1.17
Rot. Bonds2

About 1-[(1-fluorocyclopropyl)methyl]-2,5-dimethylpiperazine

1-[(1-fluorocyclopropyl)methyl]-2,5-dimethylpiperazine (PubChem CID 130678882) has the molecular formula C10H19FN2 and a molecular weight of 186.27 g/mol. Its IUPAC name is 1-[(1-fluorocyclopropyl)methyl]-2,5-dimethylpiperazine.

Molecular Properties

Compound Name1-[(1-fluorocyclopropyl)methyl]-2,5-dimethylpiperazine
PubChem CID130678882
Molecular FormulaC10H19FN2
Molecular Weight186.27 g/mol
Exact Mass186.15
IUPAC Name1-[(1-fluorocyclopropyl)methyl]-2,5-dimethylpiperazine
SMILESCC1CN(CC2(F)CC2)C(C)CN1
InChIInChI=1S/C10H19FN2/c1-8-6-13(9(2)5-12-8)7-10(11)3-4-10/h8-9,12H,3-7H2,1-2H3
InChIKeyWGHDRBMZEWXGRV-UHFFFAOYSA-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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Frequently Asked Questions

What is the IUPAC name of 1-[(1-fluorocyclopropyl)methyl]-2,5-dimethylpiperazine?
The IUPAC name of 1-[(1-fluorocyclopropyl)methyl]-2,5-dimethylpiperazine (CID 130678882) is 1-[(1-fluorocyclopropyl)methyl]-2,5-dimethylpiperazine.
What is the SMILES notation for 1-[(1-fluorocyclopropyl)methyl]-2,5-dimethylpiperazine?
The canonical SMILES for 1-[(1-fluorocyclopropyl)methyl]-2,5-dimethylpiperazine is CC1CN(CC2(F)CC2)C(C)CN1.
What is the InChIKey of 1-[(1-fluorocyclopropyl)methyl]-2,5-dimethylpiperazine?
The InChIKey is WGHDRBMZEWXGRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19FN2/c1-8-6-13(9(2)5-12-8)7-10(11)3-4-10/h8-9,12H,3-7H2,1-2H3.
What are the key properties of 1-[(1-fluorocyclopropyl)methyl]-2,5-dimethylpiperazine?
1-[(1-fluorocyclopropyl)methyl]-2,5-dimethylpiperazine 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 1-[(1-fluorocyclopropyl)methyl]-2,5-dimethylpiperazine is sourced from PubChem (CID 130678882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).