2-methyl-1-piperazin-2-ylpropan-2-ol

C8H18N2O — CID 69212654

IUPAC2-methyl-1-piperazin-2-ylpropan-2-ol
SMILESCC(C)(O)CC1CNCCN1
InChIInChI=1S/C8H18N2O/c1-8(2,11)5-7-6-9-3-4-10-7/h7,9-11H,3-6H2,1-2H3
InChIKeyQALUWTFBICFDLV-UHFFFAOYSA-N
MW158.25 g/mol
LogP-0.29
Rot. Bonds2

About 2-methyl-1-piperazin-2-ylpropan-2-ol

2-methyl-1-piperazin-2-ylpropan-2-ol (PubChem CID 69212654) has the molecular formula C8H18N2O and a molecular weight of 158.25 g/mol. Its IUPAC name is 2-methyl-1-piperazin-2-ylpropan-2-ol.

Molecular Properties

Compound Name2-methyl-1-piperazin-2-ylpropan-2-ol
PubChem CID69212654
Molecular FormulaC8H18N2O
Molecular Weight158.25 g/mol
Exact Mass158.14
IUPAC Name2-methyl-1-piperazin-2-ylpropan-2-ol
SMILESCC(C)(O)CC1CNCCN1
InChIInChI=1S/C8H18N2O/c1-8(2,11)5-7-6-9-3-4-10-7/h7,9-11H,3-6H2,1-2H3
InChIKeyQALUWTFBICFDLV-UHFFFAOYSA-N
XLogP-0.29
TPSA44.29 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.25
LogP ≤ 5-0.29
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-piperazin-2-ylpropan-2-ol?
The IUPAC name of 2-methyl-1-piperazin-2-ylpropan-2-ol (CID 69212654) is 2-methyl-1-piperazin-2-ylpropan-2-ol.
What is the SMILES notation for 2-methyl-1-piperazin-2-ylpropan-2-ol?
The canonical SMILES for 2-methyl-1-piperazin-2-ylpropan-2-ol is CC(C)(O)CC1CNCCN1.
What is the InChIKey of 2-methyl-1-piperazin-2-ylpropan-2-ol?
The InChIKey is QALUWTFBICFDLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O/c1-8(2,11)5-7-6-9-3-4-10-7/h7,9-11H,3-6H2,1-2H3.
What are the key properties of 2-methyl-1-piperazin-2-ylpropan-2-ol?
2-methyl-1-piperazin-2-ylpropan-2-ol has a molecular weight of 158.25 g/mol, XLogP of -0.29, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-piperazin-2-ylpropan-2-ol is sourced from PubChem (CID 69212654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).