1-(3-cyclohexylpropyl)piperazine

C13H26N2 — CID 2737393

IUPAC1-(3-cyclohexylpropyl)piperazine
SMILESC1CCC(CCCN2CCNCC2)CC1
InChIInChI=1S/C13H26N2/c1-2-5-13(6-3-1)7-4-10-15-11-8-14-9-12-15/h13-14H,1-12H2
InChIKeyNOANQOHRPIHTIN-UHFFFAOYSA-N
MW210.36 g/mol
LogP2.25
Rot. Bonds4

About 1-(3-cyclohexylpropyl)piperazine

1-(3-cyclohexylpropyl)piperazine (PubChem CID 2737393) has the molecular formula C13H26N2 and a molecular weight of 210.36 g/mol. Its IUPAC name is 1-(3-cyclohexylpropyl)piperazine.

Molecular Properties

Compound Name1-(3-cyclohexylpropyl)piperazine
PubChem CID2737393
Molecular FormulaC13H26N2
Molecular Weight210.36 g/mol
Exact Mass210.21
IUPAC Name1-(3-cyclohexylpropyl)piperazine
SMILESC1CCC(CCCN2CCNCC2)CC1
InChIInChI=1S/C13H26N2/c1-2-5-13(6-3-1)7-4-10-15-11-8-14-9-12-15/h13-14H,1-12H2
InChIKeyNOANQOHRPIHTIN-UHFFFAOYSA-N
XLogP2.25
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1,3-Bis(4-piperidinyl)propane
CID 85631
4-(Cyclohexylmethyl)piperidine
CID 98883
3-Cyclohexylpiperidine
CID 3809353
N-(cyclohexylmethyl)-1-ethylpiperidin-4-amine
CID 2846481
1-(4-Methyl-cyclohexyl)-piperazine hydrochloride
CID 16188159
[1-(Piperidin-1-yl)cyclohexyl]methanamine
CID 398402
2-(Decahydroisoquinolin-2-yl)ethan-1-amine
CID 5121507
1-(Cyclohexylmethyl)piperazine
CID 2735885
(2S,3S)-2-((R)-4-(3-cyclohexylpropyl)-3-isopropylpiperazin-1-yl)-N,3-dimethylpentan-1-amine
CID 45482257
N-(cyclohexylmethyl)-3-[4-[3-(cyclohexylmethylamino)propyl]piperazin-1-yl]propan-1-amine
CID 11741263
1-(Cyclohexylmethyl)piperidin-4-amine
CID 6496941
N1-(Cyclohexylmethyl)-1,4-piperazinedipropanamine
CID 44286854

Frequently Asked Questions

What is the IUPAC name of 1-(3-cyclohexylpropyl)piperazine?
The IUPAC name of 1-(3-cyclohexylpropyl)piperazine (CID 2737393) is 1-(3-cyclohexylpropyl)piperazine.
What is the SMILES notation for 1-(3-cyclohexylpropyl)piperazine?
The canonical SMILES for 1-(3-cyclohexylpropyl)piperazine is C1CCC(CCCN2CCNCC2)CC1.
What is the InChIKey of 1-(3-cyclohexylpropyl)piperazine?
The InChIKey is NOANQOHRPIHTIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2/c1-2-5-13(6-3-1)7-4-10-15-11-8-14-9-12-15/h13-14H,1-12H2.
What are the key properties of 1-(3-cyclohexylpropyl)piperazine?
1-(3-cyclohexylpropyl)piperazine has a molecular weight of 210.36 g/mol, XLogP of 2.25, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-cyclohexylpropyl)piperazine is sourced from PubChem (CID 2737393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).