2-[4-[(1R,3R)-3-methylcyclopentyl]piperazin-1-yl]ethanol

C12H24N2O — CID 30327158

IUPAC2-[4-[(1R,3R)-3-methylcyclopentyl]piperazin-1-yl]ethanol
SMILESC[C@@H]1CC[C@@H](N2CCN(CCO)CC2)C1
InChIInChI=1S/C12H24N2O/c1-11-2-3-12(10-11)14-6-4-13(5-7-14)8-9-15/h11-12,15H,2-10H2,1H3/t11-,12-/m1/s1
InChIKeyABMMEASNTBESRY-VXGBXAGGSA-N
MW212.34 g/mol
LogP0.78
Rot. Bonds3

About 2-[4-[(1R,3R)-3-methylcyclopentyl]piperazin-1-yl]ethanol

2-[4-[(1R,3R)-3-methylcyclopentyl]piperazin-1-yl]ethanol (PubChem CID 30327158) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is 2-[4-[(1R,3R)-3-methylcyclopentyl]piperazin-1-yl]ethanol.

Molecular Properties

Compound Name2-[4-[(1R,3R)-3-methylcyclopentyl]piperazin-1-yl]ethanol
PubChem CID30327158
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC Name2-[4-[(1R,3R)-3-methylcyclopentyl]piperazin-1-yl]ethanol
SMILESC[C@@H]1CC[C@@H](N2CCN(CCO)CC2)C1
InChIInChI=1S/C12H24N2O/c1-11-2-3-12(10-11)14-6-4-13(5-7-14)8-9-15/h11-12,15H,2-10H2,1H3/t11-,12-/m1/s1
InChIKeyABMMEASNTBESRY-VXGBXAGGSA-N
XLogP0.78
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 50.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[4-[1-(3-methylcyclohexyl)piperidin-4-yl]piperazin-1-yl]ethanol
CID 3708932
1-ethyl-4-[(1R,3S)-3-methylcyclopentyl]piperazine
CID 742968
cyclohexane-1,4-diol;methane;3-methylcyclopentan-1-ol;2-(4-propylpiperazin-1-yl)ethanol
CID 161047191
2-[4-(1,2,3,5,6,7,8,8a-octahydroindolizin-2-yl)piperazin-1-yl]ethanol
CID 165470380
2-[4-(2-hydroxyethyl)-1,4-diazepan-1-yl]-4-methylcyclohexane-1-carbonitrile
CID 107223072
1-ethyl-4-[(1R,3S)-3-methylcyclohexyl]piperazine
CID 784147
1-ethyl-4-[(1S,3S)-3-methylcyclohexyl]piperazine
CID 784145
1-ethyl-4-(4-methylcyclohexyl)piperazine
CID 784289
4-[(1R,3S)-3-methylcyclopentyl]morpholine
CID 7448488
2-[4-[2-[4,7-bis(2-hydroxyethyl)-1,4,7-triazonan-1-yl]ethyl]-7-(2-hydroxyethyl)-1,4,7-triazonan-1-yl]ethanol
CID 18512424
1-methyl-4-[(1R,3S)-3-methylcyclohexyl]piperazine
CID 7047259
2-[4-(1,1-dioxothiolan-3-yl)-1,4-diazepan-1-yl]ethanol
CID 63312824

Frequently Asked Questions

What is the IUPAC name of 2-[4-[(1R,3R)-3-methylcyclopentyl]piperazin-1-yl]ethanol?
The IUPAC name of 2-[4-[(1R,3R)-3-methylcyclopentyl]piperazin-1-yl]ethanol (CID 30327158) is 2-[4-[(1R,3R)-3-methylcyclopentyl]piperazin-1-yl]ethanol.
What is the SMILES notation for 2-[4-[(1R,3R)-3-methylcyclopentyl]piperazin-1-yl]ethanol?
The canonical SMILES for 2-[4-[(1R,3R)-3-methylcyclopentyl]piperazin-1-yl]ethanol is C[C@@H]1CC[C@@H](N2CCN(CCO)CC2)C1.
What is the InChIKey of 2-[4-[(1R,3R)-3-methylcyclopentyl]piperazin-1-yl]ethanol?
The InChIKey is ABMMEASNTBESRY-VXGBXAGGSA-N. The full InChI is InChI=1S/C12H24N2O/c1-11-2-3-12(10-11)14-6-4-13(5-7-14)8-9-15/h11-12,15H,2-10H2,1H3/t11-,12-/m1/s1.
What are the key properties of 2-[4-[(1R,3R)-3-methylcyclopentyl]piperazin-1-yl]ethanol?
2-[4-[(1R,3R)-3-methylcyclopentyl]piperazin-1-yl]ethanol has a molecular weight of 212.34 g/mol, XLogP of 0.78, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(1R,3R)-3-methylcyclopentyl]piperazin-1-yl]ethanol is sourced from PubChem (CID 30327158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).