1-(3-fluoropropyl)-5-methyl-2-propylpiperazine

C11H23FN2 — CID 81113110

IUPAC1-(3-fluoropropyl)-5-methyl-2-propylpiperazine
SMILESCCCC1CNC(C)CN1CCCF
InChIInChI=1S/C11H23FN2/c1-3-5-11-8-13-10(2)9-14(11)7-4-6-12/h10-11,13H,3-9H2,1-2H3
InChIKeyXDYWURCPENDWCM-UHFFFAOYSA-N
MW202.32 g/mol
LogP1.81
Rot. Bonds5

About 1-(3-fluoropropyl)-5-methyl-2-propylpiperazine

1-(3-fluoropropyl)-5-methyl-2-propylpiperazine (PubChem CID 81113110) has the molecular formula C11H23FN2 and a molecular weight of 202.32 g/mol. Its IUPAC name is 1-(3-fluoropropyl)-5-methyl-2-propylpiperazine.

Molecular Properties

Compound Name1-(3-fluoropropyl)-5-methyl-2-propylpiperazine
PubChem CID81113110
Molecular FormulaC11H23FN2
Molecular Weight202.32 g/mol
Exact Mass202.18
IUPAC Name1-(3-fluoropropyl)-5-methyl-2-propylpiperazine
SMILESCCCC1CNC(C)CN1CCCF
InChIInChI=1S/C11H23FN2/c1-3-5-11-8-13-10(2)9-14(11)7-4-6-12/h10-11,13H,3-9H2,1-2H3
InChIKeyXDYWURCPENDWCM-UHFFFAOYSA-N
XLogP1.81
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.32
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-ethyl-1-(3-fluoropropyl)-5-methylpiperazine
CID 81112995
1-(3-fluoropropyl)-2,5-dipropylpiperazine
CID 81114186
5-methyl-1-(2-propoxyethyl)-2-propylpiperazine
CID 106458506
5-methyl-1-(4-phenylbutyl)-2-propylpiperazine
CID 114334915
5-methyl-1-(2-propan-2-yloxyethyl)-2-propylpiperazine
CID 64846067
1-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-5-methyl-2-propylpiperazine
CID 104567840
3-(2-ethyl-5-methylpiperazin-1-yl)-N,N-dimethylpropan-1-amine
CID 64936336
5-ethyl-1-octyl-2-propylpiperazine
CID 64841338
1-[(2-fluorophenyl)methyl]-5-methyl-2-propylpiperazine
CID 64845681
2-ethyl-1-(4-methoxybutyl)-5-methylpiperazine
CID 64939101
1-dodecyl-2,5-dimethylpiperazine
CID 3030143
5-tert-butyl-1-heptyl-2-propylpiperazine
CID 64841631

Frequently Asked Questions

What is the IUPAC name of 1-(3-fluoropropyl)-5-methyl-2-propylpiperazine?
The IUPAC name of 1-(3-fluoropropyl)-5-methyl-2-propylpiperazine (CID 81113110) is 1-(3-fluoropropyl)-5-methyl-2-propylpiperazine.
What is the SMILES notation for 1-(3-fluoropropyl)-5-methyl-2-propylpiperazine?
The canonical SMILES for 1-(3-fluoropropyl)-5-methyl-2-propylpiperazine is CCCC1CNC(C)CN1CCCF.
What is the InChIKey of 1-(3-fluoropropyl)-5-methyl-2-propylpiperazine?
The InChIKey is XDYWURCPENDWCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23FN2/c1-3-5-11-8-13-10(2)9-14(11)7-4-6-12/h10-11,13H,3-9H2,1-2H3.
What are the key properties of 1-(3-fluoropropyl)-5-methyl-2-propylpiperazine?
1-(3-fluoropropyl)-5-methyl-2-propylpiperazine has a molecular weight of 202.32 g/mol, XLogP of 1.81, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-fluoropropyl)-5-methyl-2-propylpiperazine is sourced from PubChem (CID 81113110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).