1-cyclohexyl-4-(2-fluorophenyl)piperazine;propane

C19H31FN2 — CID 143719363

IUPAC1-cyclohexyl-4-(2-fluorophenyl)piperazine;propane
SMILESCCC.Fc1ccccc1N1CCN(C2CCCCC2)CC1
InChIInChI=1S/C16H23FN2.C3H8/c17-15-8-4-5-9-16(15)19-12-10-18(11-13-19)14-6-2-1-3-7-14;1-3-2/h4-5,8-9,14H,1-3,6-7,10-13H2;3H2,1-2H3
InChIKeyNFRNYVIDLGCNOA-UHFFFAOYSA-N
MW306.47 g/mol
LogP4.70
Rot. Bonds2

About 1-cyclohexyl-4-(2-fluorophenyl)piperazine;propane

1-cyclohexyl-4-(2-fluorophenyl)piperazine;propane (PubChem CID 143719363) has the molecular formula C19H31FN2 and a molecular weight of 306.47 g/mol. Its IUPAC name is 1-cyclohexyl-4-(2-fluorophenyl)piperazine;propane.

Molecular Properties

Compound Name1-cyclohexyl-4-(2-fluorophenyl)piperazine;propane
PubChem CID143719363
Molecular FormulaC19H31FN2
Molecular Weight306.47 g/mol
Exact Mass306.25
IUPAC Name1-cyclohexyl-4-(2-fluorophenyl)piperazine;propane
SMILESCCC.Fc1ccccc1N1CCN(C2CCCCC2)CC1
InChIInChI=1S/C16H23FN2.C3H8/c17-15-8-4-5-9-16(15)19-12-10-18(11-13-19)14-6-2-1-3-7-14;1-3-2/h4-5,8-9,14H,1-3,6-7,10-13H2;3H2,1-2H3
InChIKeyNFRNYVIDLGCNOA-UHFFFAOYSA-N
XLogP4.70
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.47
LogP ≤ 54.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-4-(2-fluorophenyl)piperazine;propane?
The IUPAC name of 1-cyclohexyl-4-(2-fluorophenyl)piperazine;propane (CID 143719363) is 1-cyclohexyl-4-(2-fluorophenyl)piperazine;propane.
What is the SMILES notation for 1-cyclohexyl-4-(2-fluorophenyl)piperazine;propane?
The canonical SMILES for 1-cyclohexyl-4-(2-fluorophenyl)piperazine;propane is CCC.Fc1ccccc1N1CCN(C2CCCCC2)CC1.
What is the InChIKey of 1-cyclohexyl-4-(2-fluorophenyl)piperazine;propane?
The InChIKey is NFRNYVIDLGCNOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23FN2.C3H8/c17-15-8-4-5-9-16(15)19-12-10-18(11-13-19)14-6-2-1-3-7-14;1-3-2/h4-5,8-9,14H,1-3,6-7,10-13H2;3H2,1-2H3.
What are the key properties of 1-cyclohexyl-4-(2-fluorophenyl)piperazine;propane?
1-cyclohexyl-4-(2-fluorophenyl)piperazine;propane has a molecular weight of 306.47 g/mol, XLogP of 4.70, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-4-(2-fluorophenyl)piperazine;propane is sourced from PubChem (CID 143719363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).