1-(5-ethylpiperazin-2-yl)-2-methylpropan-2-ol

C10H22N2O — CID 123687719

IUPAC1-(5-ethylpiperazin-2-yl)-2-methylpropan-2-ol
SMILESCCC1CNC(CC(C)(C)O)CN1
InChIInChI=1S/C10H22N2O/c1-4-8-6-12-9(7-11-8)5-10(2,3)13/h8-9,11-13H,4-7H2,1-3H3
InChIKeyMSWUYRADRUMBHD-UHFFFAOYSA-N
MW186.30 g/mol
LogP0.49
Rot. Bonds3

About 1-(5-ethylpiperazin-2-yl)-2-methylpropan-2-ol

1-(5-ethylpiperazin-2-yl)-2-methylpropan-2-ol (PubChem CID 123687719) has the molecular formula C10H22N2O and a molecular weight of 186.30 g/mol. Its IUPAC name is 1-(5-ethylpiperazin-2-yl)-2-methylpropan-2-ol.

Molecular Properties

Compound Name1-(5-ethylpiperazin-2-yl)-2-methylpropan-2-ol
PubChem CID123687719
Molecular FormulaC10H22N2O
Molecular Weight186.30 g/mol
Exact Mass186.17
IUPAC Name1-(5-ethylpiperazin-2-yl)-2-methylpropan-2-ol
SMILESCCC1CNC(CC(C)(C)O)CN1
InChIInChI=1S/C10H22N2O/c1-4-8-6-12-9(7-11-8)5-10(2,3)13/h8-9,11-13H,4-7H2,1-3H3
InChIKeyMSWUYRADRUMBHD-UHFFFAOYSA-N
XLogP0.49
TPSA44.29 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 50.49
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 20496650
3-Methyl-2-(piperazin-2-yl)butan-2-ol
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Hydroxyethyl piperazine-2-ethane
CID 140201774
5,5,5-Trifluoro-2-methyl-4-piperazin-1-ylpentan-2-ol
CID 83824795
4-(2-Aminopropyl)-1-methylpiperidin-4-ol
CID 15639443
3-Ethyl-1-piperazin-1-ylpentan-3-ol
CID 12052552
2-Methyl-5-piperazin-1-ylpentan-2-ol
CID 12052556
2-Methyl-1-[1-(oxoboranylmethyl)piperazin-2-yl]propan-2-ol
CID 20701022
1-(1-Methanidylazetidin-1-ium-3-yl)-4-methylpiperidin-4-ol
CID 21029887
1-(Azetidin-3-yl)-4-methylpiperidin-4-ol
CID 21029908
(S)-2-methyl-1-piperazin-2-yl-propan-2-ol
CID 45099480
4-Piperidinol, 2,4,6-trimethyl-
CID 55287595

Frequently Asked Questions

What is the IUPAC name of 1-(5-ethylpiperazin-2-yl)-2-methylpropan-2-ol?
The IUPAC name of 1-(5-ethylpiperazin-2-yl)-2-methylpropan-2-ol (CID 123687719) is 1-(5-ethylpiperazin-2-yl)-2-methylpropan-2-ol.
What is the SMILES notation for 1-(5-ethylpiperazin-2-yl)-2-methylpropan-2-ol?
The canonical SMILES for 1-(5-ethylpiperazin-2-yl)-2-methylpropan-2-ol is CCC1CNC(CC(C)(C)O)CN1.
What is the InChIKey of 1-(5-ethylpiperazin-2-yl)-2-methylpropan-2-ol?
The InChIKey is MSWUYRADRUMBHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O/c1-4-8-6-12-9(7-11-8)5-10(2,3)13/h8-9,11-13H,4-7H2,1-3H3.
What are the key properties of 1-(5-ethylpiperazin-2-yl)-2-methylpropan-2-ol?
1-(5-ethylpiperazin-2-yl)-2-methylpropan-2-ol has a molecular weight of 186.30 g/mol, XLogP of 0.49, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-ethylpiperazin-2-yl)-2-methylpropan-2-ol is sourced from PubChem (CID 123687719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).