1-[2-(4-fluorophenyl)propyl]-2-methylpiperazine

C14H21FN2 — CID 120837102

IUPAC1-[2-(4-fluorophenyl)propyl]-2-methylpiperazine
SMILESCC(CN1CCNCC1C)c1ccc(F)cc1
InChIInChI=1S/C14H21FN2/c1-11(13-3-5-14(15)6-4-13)10-17-8-7-16-9-12(17)2/h3-6,11-12,16H,7-10H2,1-2H3
InChIKeyICZPXDUEFCFESM-UHFFFAOYSA-N
MW236.33 g/mol
LogP2.22
Rot. Bonds3

About 1-[2-(4-fluorophenyl)propyl]-2-methylpiperazine

1-[2-(4-fluorophenyl)propyl]-2-methylpiperazine (PubChem CID 120837102) has the molecular formula C14H21FN2 and a molecular weight of 236.33 g/mol. Its IUPAC name is 1-[2-(4-fluorophenyl)propyl]-2-methylpiperazine.

Molecular Properties

Compound Name1-[2-(4-fluorophenyl)propyl]-2-methylpiperazine
PubChem CID120837102
Molecular FormulaC14H21FN2
Molecular Weight236.33 g/mol
Exact Mass236.17
IUPAC Name1-[2-(4-fluorophenyl)propyl]-2-methylpiperazine
SMILESCC(CN1CCNCC1C)c1ccc(F)cc1
InChIInChI=1S/C14H21FN2/c1-11(13-3-5-14(15)6-4-13)10-17-8-7-16-9-12(17)2/h3-6,11-12,16H,7-10H2,1-2H3
InChIKeyICZPXDUEFCFESM-UHFFFAOYSA-N
XLogP2.22
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.33
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(4-fluorophenyl)propyl]-2-methylpiperazine?
The IUPAC name of 1-[2-(4-fluorophenyl)propyl]-2-methylpiperazine (CID 120837102) is 1-[2-(4-fluorophenyl)propyl]-2-methylpiperazine.
What is the SMILES notation for 1-[2-(4-fluorophenyl)propyl]-2-methylpiperazine?
The canonical SMILES for 1-[2-(4-fluorophenyl)propyl]-2-methylpiperazine is CC(CN1CCNCC1C)c1ccc(F)cc1.
What is the InChIKey of 1-[2-(4-fluorophenyl)propyl]-2-methylpiperazine?
The InChIKey is ICZPXDUEFCFESM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21FN2/c1-11(13-3-5-14(15)6-4-13)10-17-8-7-16-9-12(17)2/h3-6,11-12,16H,7-10H2,1-2H3.
What are the key properties of 1-[2-(4-fluorophenyl)propyl]-2-methylpiperazine?
1-[2-(4-fluorophenyl)propyl]-2-methylpiperazine has a molecular weight of 236.33 g/mol, XLogP of 2.22, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(4-fluorophenyl)propyl]-2-methylpiperazine is sourced from PubChem (CID 120837102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).