2-[3-(2-methylpropyl)piperazin-1-yl]ethanol

C10H22N2O — CID 112546379

IUPAC2-[3-(2-methylpropyl)piperazin-1-yl]ethanol
SMILESCC(C)CC1CN(CCO)CCN1
InChIInChI=1S/C10H22N2O/c1-9(2)7-10-8-12(5-6-13)4-3-11-10/h9-11,13H,3-8H2,1-2H3
InChIKeyRIDXPNATBNSODZ-UHFFFAOYSA-N
MW186.30 g/mol
LogP0.30
Rot. Bonds4

About 2-[3-(2-methylpropyl)piperazin-1-yl]ethanol

2-[3-(2-methylpropyl)piperazin-1-yl]ethanol (PubChem CID 112546379) has the molecular formula C10H22N2O and a molecular weight of 186.30 g/mol. Its IUPAC name is 2-[3-(2-methylpropyl)piperazin-1-yl]ethanol.

Molecular Properties

Compound Name2-[3-(2-methylpropyl)piperazin-1-yl]ethanol
PubChem CID112546379
Molecular FormulaC10H22N2O
Molecular Weight186.30 g/mol
Exact Mass186.17
IUPAC Name2-[3-(2-methylpropyl)piperazin-1-yl]ethanol
SMILESCC(C)CC1CN(CCO)CCN1
InChIInChI=1S/C10H22N2O/c1-9(2)7-10-8-12(5-6-13)4-3-11-10/h9-11,13H,3-8H2,1-2H3
InChIKeyRIDXPNATBNSODZ-UHFFFAOYSA-N
XLogP0.30
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 50.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-fluoroethyl)-3-(2-methylpropyl)piperazine
CID 80695147
1-hexyl-3-(2-methylpropyl)piperazine
CID 64834623
1-[3-(2-methoxyethoxy)propyl]-3-(2-methylpropyl)piperazine
CID 103414044
1-[2-[3-(2-methylpropyl)piperazin-1-yl]ethyl]pyridin-2-one
CID 82907814
3-(2-methylpropyl)-1-[(2-methyltetrazol-5-yl)methyl]piperazine
CID 107055316
1-(3-fluoropropyl)-3-(2-methylpropyl)-1,4-diazepane
CID 81113598
1-methanidyl-3-(2-methylpropyl)piperazine
CID 59704463
3-(2-methylpropyl)-1-[2-(2-methylpyrazol-3-yl)ethyl]piperazine
CID 103016164
2-[[3-(2-methylpropyl)piperazin-1-yl]methyl]pyrimidine
CID 64834432
2-methyl-4-[2-[3-(2-methylpropyl)piperazin-1-yl]ethyl]-1,3-thiazole
CID 106043488
3-(2-methylpropyl)-1-(4-methylsulfanylbutyl)-1,4-diazepane
CID 113488331
3-(2-methylpropyl)piperazine-1-carboxamide
CID 90242604

Frequently Asked Questions

What is the IUPAC name of 2-[3-(2-methylpropyl)piperazin-1-yl]ethanol?
The IUPAC name of 2-[3-(2-methylpropyl)piperazin-1-yl]ethanol (CID 112546379) is 2-[3-(2-methylpropyl)piperazin-1-yl]ethanol.
What is the SMILES notation for 2-[3-(2-methylpropyl)piperazin-1-yl]ethanol?
The canonical SMILES for 2-[3-(2-methylpropyl)piperazin-1-yl]ethanol is CC(C)CC1CN(CCO)CCN1.
What is the InChIKey of 2-[3-(2-methylpropyl)piperazin-1-yl]ethanol?
The InChIKey is RIDXPNATBNSODZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O/c1-9(2)7-10-8-12(5-6-13)4-3-11-10/h9-11,13H,3-8H2,1-2H3.
What are the key properties of 2-[3-(2-methylpropyl)piperazin-1-yl]ethanol?
2-[3-(2-methylpropyl)piperazin-1-yl]ethanol has a molecular weight of 186.30 g/mol, XLogP of 0.30, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(2-methylpropyl)piperazin-1-yl]ethanol is sourced from PubChem (CID 112546379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).