[(2S)-1,4-dimethylpiperazin-2-yl]methanol

C7H16N2O — CID 7035990

IUPAC[(2S)-1,4-dimethylpiperazin-2-yl]methanol
SMILESCN1CCN(C)[C@H](CO)C1
InChIInChI=1S/C7H16N2O/c1-8-3-4-9(2)7(5-8)6-10/h7,10H,3-6H2,1-2H3/t7-/m0/s1
InChIKeyZEHZRJZZIYNPKU-ZETCQYMHSA-N
MW144.22 g/mol
LogP-0.78
Rot. Bonds1

About [(2S)-1,4-dimethylpiperazin-2-yl]methanol

[(2S)-1,4-dimethylpiperazin-2-yl]methanol (PubChem CID 7035990) has the molecular formula C7H16N2O and a molecular weight of 144.22 g/mol. Its IUPAC name is [(2S)-1,4-dimethylpiperazin-2-yl]methanol.

Molecular Properties

Compound Name[(2S)-1,4-dimethylpiperazin-2-yl]methanol
PubChem CID7035990
Molecular FormulaC7H16N2O
Molecular Weight144.22 g/mol
Exact Mass144.13
IUPAC Name[(2S)-1,4-dimethylpiperazin-2-yl]methanol
SMILESCN1CCN(C)[C@H](CO)C1
InChIInChI=1S/C7H16N2O/c1-8-3-4-9(2)7(5-8)6-10/h7,10H,3-6H2,1-2H3/t7-/m0/s1
InChIKeyZEHZRJZZIYNPKU-ZETCQYMHSA-N
XLogP-0.78
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.22
LogP ≤ 5-0.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [(2S)-1,4-dimethylpiperazin-2-yl]methanol?
The IUPAC name of [(2S)-1,4-dimethylpiperazin-2-yl]methanol (CID 7035990) is [(2S)-1,4-dimethylpiperazin-2-yl]methanol.
What is the SMILES notation for [(2S)-1,4-dimethylpiperazin-2-yl]methanol?
The canonical SMILES for [(2S)-1,4-dimethylpiperazin-2-yl]methanol is CN1CCN(C)[C@H](CO)C1.
What is the InChIKey of [(2S)-1,4-dimethylpiperazin-2-yl]methanol?
The InChIKey is ZEHZRJZZIYNPKU-ZETCQYMHSA-N. The full InChI is InChI=1S/C7H16N2O/c1-8-3-4-9(2)7(5-8)6-10/h7,10H,3-6H2,1-2H3/t7-/m0/s1.
What are the key properties of [(2S)-1,4-dimethylpiperazin-2-yl]methanol?
[(2S)-1,4-dimethylpiperazin-2-yl]methanol has a molecular weight of 144.22 g/mol, XLogP of -0.78, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2S)-1,4-dimethylpiperazin-2-yl]methanol is sourced from PubChem (CID 7035990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).