2-[2-hydroxyethyl(imidazo[1,2-a]pyrimidin-2-ylmethyl)amino]ethanol

C11H16N4O2 — CID 23849163

IUPAC2-[2-hydroxyethyl(imidazo[1,2-a]pyrimidin-2-ylmethyl)amino]ethanol
SMILESOCCN(CCO)Cc1cn2cccnc2n1
InChIInChI=1S/C11H16N4O2/c16-6-4-14(5-7-17)8-10-9-15-3-1-2-12-11(15)13-10/h1-3,9,16-17H,4-8H2
InChIKeyHGXWLBNWZLBMFW-UHFFFAOYSA-N
MW236.27 g/mol
LogP-0.48
Rot. Bonds6

About 2-[2-hydroxyethyl(imidazo[1,2-a]pyrimidin-2-ylmethyl)amino]ethanol

2-[2-hydroxyethyl(imidazo[1,2-a]pyrimidin-2-ylmethyl)amino]ethanol (PubChem CID 23849163) has the molecular formula C11H16N4O2 and a molecular weight of 236.27 g/mol. Its IUPAC name is 2-[2-hydroxyethyl(imidazo[1,2-a]pyrimidin-2-ylmethyl)amino]ethanol.

Molecular Properties

Compound Name2-[2-hydroxyethyl(imidazo[1,2-a]pyrimidin-2-ylmethyl)amino]ethanol
PubChem CID23849163
Molecular FormulaC11H16N4O2
Molecular Weight236.27 g/mol
Exact Mass236.13
IUPAC Name2-[2-hydroxyethyl(imidazo[1,2-a]pyrimidin-2-ylmethyl)amino]ethanol
SMILESOCCN(CCO)Cc1cn2cccnc2n1
InChIInChI=1S/C11H16N4O2/c16-6-4-14(5-7-17)8-10-9-15-3-1-2-12-11(15)13-10/h1-3,9,16-17H,4-8H2
InChIKeyHGXWLBNWZLBMFW-UHFFFAOYSA-N
XLogP-0.48
TPSA73.89 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.27
LogP ≤ 5-0.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[2-hydroxyethyl(imidazo[1,2-a]pyrimidin-2-ylmethyl)amino]ethanol?
The IUPAC name of 2-[2-hydroxyethyl(imidazo[1,2-a]pyrimidin-2-ylmethyl)amino]ethanol (CID 23849163) is 2-[2-hydroxyethyl(imidazo[1,2-a]pyrimidin-2-ylmethyl)amino]ethanol.
What is the SMILES notation for 2-[2-hydroxyethyl(imidazo[1,2-a]pyrimidin-2-ylmethyl)amino]ethanol?
The canonical SMILES for 2-[2-hydroxyethyl(imidazo[1,2-a]pyrimidin-2-ylmethyl)amino]ethanol is OCCN(CCO)Cc1cn2cccnc2n1.
What is the InChIKey of 2-[2-hydroxyethyl(imidazo[1,2-a]pyrimidin-2-ylmethyl)amino]ethanol?
The InChIKey is HGXWLBNWZLBMFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O2/c16-6-4-14(5-7-17)8-10-9-15-3-1-2-12-11(15)13-10/h1-3,9,16-17H,4-8H2.
What are the key properties of 2-[2-hydroxyethyl(imidazo[1,2-a]pyrimidin-2-ylmethyl)amino]ethanol?
2-[2-hydroxyethyl(imidazo[1,2-a]pyrimidin-2-ylmethyl)amino]ethanol has a molecular weight of 236.27 g/mol, XLogP of -0.48, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-hydroxyethyl(imidazo[1,2-a]pyrimidin-2-ylmethyl)amino]ethanol is sourced from PubChem (CID 23849163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).