[4-[[1-(2-methoxyethyl)imidazol-2-yl]methyl]-1-methylpiperazin-2-yl]methanol

C13H24N4O2 — CID 86284570

IUPAC[4-[[1-(2-methoxyethyl)imidazol-2-yl]methyl]-1-methylpiperazin-2-yl]methanol
SMILESCOCCn1ccnc1CN1CCN(C)C(CO)C1
InChIInChI=1S/C13H24N4O2/c1-15-5-6-16(9-12(15)11-18)10-13-14-3-4-17(13)7-8-19-2/h3-4,12,18H,5-11H2,1-2H3
InChIKeyDBIWZKNOOVCVOB-UHFFFAOYSA-N
MW268.36 g/mol
LogP-0.36
Rot. Bonds6

About [4-[[1-(2-methoxyethyl)imidazol-2-yl]methyl]-1-methylpiperazin-2-yl]methanol

[4-[[1-(2-methoxyethyl)imidazol-2-yl]methyl]-1-methylpiperazin-2-yl]methanol (PubChem CID 86284570) has the molecular formula C13H24N4O2 and a molecular weight of 268.36 g/mol. Its IUPAC name is [4-[[1-(2-methoxyethyl)imidazol-2-yl]methyl]-1-methylpiperazin-2-yl]methanol.

Molecular Properties

Compound Name[4-[[1-(2-methoxyethyl)imidazol-2-yl]methyl]-1-methylpiperazin-2-yl]methanol
PubChem CID86284570
Molecular FormulaC13H24N4O2
Molecular Weight268.36 g/mol
Exact Mass268.19
IUPAC Name[4-[[1-(2-methoxyethyl)imidazol-2-yl]methyl]-1-methylpiperazin-2-yl]methanol
SMILESCOCCn1ccnc1CN1CCN(C)C(CO)C1
InChIInChI=1S/C13H24N4O2/c1-15-5-6-16(9-12(15)11-18)10-13-14-3-4-17(13)7-8-19-2/h3-4,12,18H,5-11H2,1-2H3
InChIKeyDBIWZKNOOVCVOB-UHFFFAOYSA-N
XLogP-0.36
TPSA53.76 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 5-0.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of [4-[[1-(2-methoxyethyl)imidazol-2-yl]methyl]-1-methylpiperazin-2-yl]methanol?
The IUPAC name of [4-[[1-(2-methoxyethyl)imidazol-2-yl]methyl]-1-methylpiperazin-2-yl]methanol (CID 86284570) is [4-[[1-(2-methoxyethyl)imidazol-2-yl]methyl]-1-methylpiperazin-2-yl]methanol.
What is the SMILES notation for [4-[[1-(2-methoxyethyl)imidazol-2-yl]methyl]-1-methylpiperazin-2-yl]methanol?
The canonical SMILES for [4-[[1-(2-methoxyethyl)imidazol-2-yl]methyl]-1-methylpiperazin-2-yl]methanol is COCCn1ccnc1CN1CCN(C)C(CO)C1.
What is the InChIKey of [4-[[1-(2-methoxyethyl)imidazol-2-yl]methyl]-1-methylpiperazin-2-yl]methanol?
The InChIKey is DBIWZKNOOVCVOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N4O2/c1-15-5-6-16(9-12(15)11-18)10-13-14-3-4-17(13)7-8-19-2/h3-4,12,18H,5-11H2,1-2H3.
What are the key properties of [4-[[1-(2-methoxyethyl)imidazol-2-yl]methyl]-1-methylpiperazin-2-yl]methanol?
[4-[[1-(2-methoxyethyl)imidazol-2-yl]methyl]-1-methylpiperazin-2-yl]methanol has a molecular weight of 268.36 g/mol, XLogP of -0.36, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[[1-(2-methoxyethyl)imidazol-2-yl]methyl]-1-methylpiperazin-2-yl]methanol is sourced from PubChem (CID 86284570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).