1-(2,2-dimethylpiperazin-1-yl)-3-methoxypropan-2-ol

C10H22N2O2 — CID 65460991

IUPAC1-(2,2-dimethylpiperazin-1-yl)-3-methoxypropan-2-ol
SMILESCOCC(O)CN1CCNCC1(C)C
InChIInChI=1S/C10H22N2O2/c1-10(2)8-11-4-5-12(10)6-9(13)7-14-3/h9,11,13H,4-8H2,1-3H3
InChIKeyQAAOBCDZDSJSRY-UHFFFAOYSA-N
MW202.30 g/mol
LogP-0.32
Rot. Bonds4

About 1-(2,2-dimethylpiperazin-1-yl)-3-methoxypropan-2-ol

1-(2,2-dimethylpiperazin-1-yl)-3-methoxypropan-2-ol (PubChem CID 65460991) has the molecular formula C10H22N2O2 and a molecular weight of 202.30 g/mol. Its IUPAC name is 1-(2,2-dimethylpiperazin-1-yl)-3-methoxypropan-2-ol.

Molecular Properties

Compound Name1-(2,2-dimethylpiperazin-1-yl)-3-methoxypropan-2-ol
PubChem CID65460991
Molecular FormulaC10H22N2O2
Molecular Weight202.30 g/mol
Exact Mass202.17
IUPAC Name1-(2,2-dimethylpiperazin-1-yl)-3-methoxypropan-2-ol
SMILESCOCC(O)CN1CCNCC1(C)C
InChIInChI=1S/C10H22N2O2/c1-10(2)8-11-4-5-12(10)6-9(13)7-14-3/h9,11,13H,4-8H2,1-3H3
InChIKeyQAAOBCDZDSJSRY-UHFFFAOYSA-N
XLogP-0.32
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 5-0.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(2,2-dimethylpiperazin-1-yl)-3-methoxypropan-2-ol?
The IUPAC name of 1-(2,2-dimethylpiperazin-1-yl)-3-methoxypropan-2-ol (CID 65460991) is 1-(2,2-dimethylpiperazin-1-yl)-3-methoxypropan-2-ol.
What is the SMILES notation for 1-(2,2-dimethylpiperazin-1-yl)-3-methoxypropan-2-ol?
The canonical SMILES for 1-(2,2-dimethylpiperazin-1-yl)-3-methoxypropan-2-ol is COCC(O)CN1CCNCC1(C)C.
What is the InChIKey of 1-(2,2-dimethylpiperazin-1-yl)-3-methoxypropan-2-ol?
The InChIKey is QAAOBCDZDSJSRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O2/c1-10(2)8-11-4-5-12(10)6-9(13)7-14-3/h9,11,13H,4-8H2,1-3H3.
What are the key properties of 1-(2,2-dimethylpiperazin-1-yl)-3-methoxypropan-2-ol?
1-(2,2-dimethylpiperazin-1-yl)-3-methoxypropan-2-ol has a molecular weight of 202.30 g/mol, XLogP of -0.32, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2-dimethylpiperazin-1-yl)-3-methoxypropan-2-ol is sourced from PubChem (CID 65460991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).