1-cyclohexyl-4-(3-naphthalen-1-ylpropyl)piperazine

C23H32N2 — CID 11739209

IUPAC1-cyclohexyl-4-(3-naphthalen-1-ylpropyl)piperazine
SMILESc1ccc2c(CCCN3CCN(C4CCCCC4)CC3)cccc2c1
InChIInChI=1S/C23H32N2/c1-2-12-22(13-3-1)25-18-16-24(17-19-25)15-7-11-21-10-6-9-20-8-4-5-14-23(20)21/h4-6,8-10,14,22H,1-3,7,11-13,15-19H2
InChIKeyJUUYFYSVESOHNG-UHFFFAOYSA-N
MW336.52 g/mol
LogP4.72
Rot. Bonds5

About 1-cyclohexyl-4-(3-naphthalen-1-ylpropyl)piperazine

1-cyclohexyl-4-(3-naphthalen-1-ylpropyl)piperazine (PubChem CID 11739209) has the molecular formula C23H32N2 and a molecular weight of 336.52 g/mol. Its IUPAC name is 1-cyclohexyl-4-(3-naphthalen-1-ylpropyl)piperazine.

Molecular Properties

Compound Name1-cyclohexyl-4-(3-naphthalen-1-ylpropyl)piperazine
PubChem CID11739209
Molecular FormulaC23H32N2
Molecular Weight336.52 g/mol
Exact Mass336.26
IUPAC Name1-cyclohexyl-4-(3-naphthalen-1-ylpropyl)piperazine
SMILESc1ccc2c(CCCN3CCN(C4CCCCC4)CC3)cccc2c1
InChIInChI=1S/C23H32N2/c1-2-12-22(13-3-1)25-18-16-24(17-19-25)15-7-11-21-10-6-9-20-8-4-5-14-23(20)21/h4-6,8-10,14,22H,1-3,7,11-13,15-19H2
InChIKeyJUUYFYSVESOHNG-UHFFFAOYSA-N
XLogP4.72
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.52
LogP ≤ 54.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Cinnarizine
CID 1547484
(E)-1-Benzhydryl-4-cinnamylpiperazine
CID 1615336
MT-45
CID 431865
4-(10H-anthracen-9-ylidene)-1-methyl-piperidine
CID 10468648
1-(Diphenylmethyl)-4-(3-phenylprop-2-enyl)piperazine
CID 2761
1-(2-(Naphthalen-2-yl)ethyl)piperazine
CID 44592243
(2S)-N,N-dimethyl-5-naphthalen-1-yl-1,2,3,4-tetrahydronaphthalen-2-amine
CID 10402615
(S)-5-phenyl-N,N-dipropyl-1,2,3,4-tetrahydronaphthalen-2-amine
CID 11186985
1-Cyclohexyl-4-[3-(1,2,3,4-tetrahydro-naphthalen-1-yl)-propyl]-piperazine
CID 11233111
3-(Naphth-2-yl)-8-methyl-8-azabicyclo[3.2.1]octane
CID 18689926
n,n-Dimethyl-1-(1-(naphthalen-2-yl)cyclohexyl)ethanamine
CID 20111627
n,n-Dimethyl-1-(1-(naphthalen-1-yl)cyclohexyl)methanamine
CID 53323771

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-4-(3-naphthalen-1-ylpropyl)piperazine?
The IUPAC name of 1-cyclohexyl-4-(3-naphthalen-1-ylpropyl)piperazine (CID 11739209) is 1-cyclohexyl-4-(3-naphthalen-1-ylpropyl)piperazine.
What is the SMILES notation for 1-cyclohexyl-4-(3-naphthalen-1-ylpropyl)piperazine?
The canonical SMILES for 1-cyclohexyl-4-(3-naphthalen-1-ylpropyl)piperazine is c1ccc2c(CCCN3CCN(C4CCCCC4)CC3)cccc2c1.
What is the InChIKey of 1-cyclohexyl-4-(3-naphthalen-1-ylpropyl)piperazine?
The InChIKey is JUUYFYSVESOHNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H32N2/c1-2-12-22(13-3-1)25-18-16-24(17-19-25)15-7-11-21-10-6-9-20-8-4-5-14-23(20)21/h4-6,8-10,14,22H,1-3,7,11-13,15-19H2.
What are the key properties of 1-cyclohexyl-4-(3-naphthalen-1-ylpropyl)piperazine?
1-cyclohexyl-4-(3-naphthalen-1-ylpropyl)piperazine has a molecular weight of 336.52 g/mol, XLogP of 4.72, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-4-(3-naphthalen-1-ylpropyl)piperazine is sourced from PubChem (CID 11739209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).