1-[(3R)-hexan-3-yl]piperazine

C10H22N2 — CID 94350939

IUPAC1-[(3R)-hexan-3-yl]piperazine
SMILESCCC[C@@H](CC)N1CCNCC1
InChIInChI=1S/C10H22N2/c1-3-5-10(4-2)12-8-6-11-7-9-12/h10-11H,3-9H2,1-2H3/t10-/m1/s1
InChIKeyDOYGAJODJLYPHM-SNVBAGLBSA-N
MW170.30 g/mol
LogP1.47
Rot. Bonds4

About 1-[(3R)-hexan-3-yl]piperazine

1-[(3R)-hexan-3-yl]piperazine (PubChem CID 94350939) has the molecular formula C10H22N2 and a molecular weight of 170.30 g/mol. Its IUPAC name is 1-[(3R)-hexan-3-yl]piperazine.

Molecular Properties

Compound Name1-[(3R)-hexan-3-yl]piperazine
PubChem CID94350939
Molecular FormulaC10H22N2
Molecular Weight170.30 g/mol
Exact Mass170.18
IUPAC Name1-[(3R)-hexan-3-yl]piperazine
SMILESCCC[C@@H](CC)N1CCNCC1
InChIInChI=1S/C10H22N2/c1-3-5-10(4-2)12-8-6-11-7-9-12/h10-11H,3-9H2,1-2H3/t10-/m1/s1
InChIKeyDOYGAJODJLYPHM-SNVBAGLBSA-N
XLogP1.47
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.30
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(1-piperazin-1-ylpentan-3-yl)piperazine
CID 57104516
N-methyl-4-piperazin-1-ylheptan-1-amine
CID 143122389
fluoromethane;1-(1-methoxybutan-2-yl)piperazine
CID 162038929
1-(1-heptan-4-ylazetidin-3-yl)piperazine
CID 66203956
1-[(1S)-1-(2,3,4,5,6-pentafluorophenyl)butyl]piperazine;hydrochloride
CID 171166800
1-oct-1-en-4-ylpiperazine
CID 66656053
1-[(1R)-1-(2,3,4,5,6-pentafluorophenyl)butyl]piperazine;hydrochloride
CID 171172161
1-(1-fluoropropyl)piperazine
CID 91569783
3-hexan-3-yl-3-azabicyclo[3.1.0]hexane
CID 139359244
1-(1-bromopropyl)piperazine
CID 135292234
1-[(2S)-1,1,1-trifluoropentan-2-yl]piperazine;dihydrochloride
CID 171276178
2-(1,4-diazepan-1-yl)hexan-1-ol
CID 61352767

Frequently Asked Questions

What is the IUPAC name of 1-[(3R)-hexan-3-yl]piperazine?
The IUPAC name of 1-[(3R)-hexan-3-yl]piperazine (CID 94350939) is 1-[(3R)-hexan-3-yl]piperazine.
What is the SMILES notation for 1-[(3R)-hexan-3-yl]piperazine?
The canonical SMILES for 1-[(3R)-hexan-3-yl]piperazine is CCC[C@@H](CC)N1CCNCC1.
What is the InChIKey of 1-[(3R)-hexan-3-yl]piperazine?
The InChIKey is DOYGAJODJLYPHM-SNVBAGLBSA-N. The full InChI is InChI=1S/C10H22N2/c1-3-5-10(4-2)12-8-6-11-7-9-12/h10-11H,3-9H2,1-2H3/t10-/m1/s1.
What are the key properties of 1-[(3R)-hexan-3-yl]piperazine?
1-[(3R)-hexan-3-yl]piperazine has a molecular weight of 170.30 g/mol, XLogP of 1.47, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3R)-hexan-3-yl]piperazine is sourced from PubChem (CID 94350939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).