2-imidazolidin-1-ylethanol

C5H12N2O — CID 18172740

IUPAC2-imidazolidin-1-ylethanol
SMILESOCCN1CCNC1
InChIInChI=1S/C5H12N2O/c8-4-3-7-2-1-6-5-7/h6,8H,1-5H2
InChIKeyRELOFIKZGIJATN-UHFFFAOYSA-N
MW116.16 g/mol
LogP-1.16
Rot. Bonds2

About 2-imidazolidin-1-ylethanol

2-imidazolidin-1-ylethanol (PubChem CID 18172740) has the molecular formula C5H12N2O and a molecular weight of 116.16 g/mol. Its IUPAC name is 2-imidazolidin-1-ylethanol.

Molecular Properties

Compound Name2-imidazolidin-1-ylethanol
PubChem CID18172740
Molecular FormulaC5H12N2O
Molecular Weight116.16 g/mol
Exact Mass116.09
IUPAC Name2-imidazolidin-1-ylethanol
SMILESOCCN1CCNC1
InChIInChI=1S/C5H12N2O/c8-4-3-7-2-1-6-5-7/h6,8H,1-5H2
InChIKeyRELOFIKZGIJATN-UHFFFAOYSA-N
XLogP-1.16
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500116.16
LogP ≤ 5-1.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-imidazolidin-1-ylethanol?
The IUPAC name of 2-imidazolidin-1-ylethanol (CID 18172740) is 2-imidazolidin-1-ylethanol.
What is the SMILES notation for 2-imidazolidin-1-ylethanol?
The canonical SMILES for 2-imidazolidin-1-ylethanol is OCCN1CCNC1.
What is the InChIKey of 2-imidazolidin-1-ylethanol?
The InChIKey is RELOFIKZGIJATN-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12N2O/c8-4-3-7-2-1-6-5-7/h6,8H,1-5H2.
What are the key properties of 2-imidazolidin-1-ylethanol?
2-imidazolidin-1-ylethanol has a molecular weight of 116.16 g/mol, XLogP of -1.16, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-imidazolidin-1-ylethanol is sourced from PubChem (CID 18172740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).