2-ethyl-1-propan-2-ylimidazol-4-ol

C8H14N2O — CID 13150380

IUPAC2-ethyl-1-propan-2-ylimidazol-4-ol
SMILESCCc1nc(O)cn1C(C)C
InChIInChI=1S/C8H14N2O/c1-4-7-9-8(11)5-10(7)6(2)3/h5-6,11H,4H2,1-3H3
InChIKeyAZKRXAYDOHPFSI-UHFFFAOYSA-N
MW154.21 g/mol
LogP1.73
Rot. Bonds2

About 2-ethyl-1-propan-2-ylimidazol-4-ol

2-ethyl-1-propan-2-ylimidazol-4-ol (PubChem CID 13150380) has the molecular formula C8H14N2O and a molecular weight of 154.21 g/mol. Its IUPAC name is 2-ethyl-1-propan-2-ylimidazol-4-ol.

Molecular Properties

Compound Name2-ethyl-1-propan-2-ylimidazol-4-ol
PubChem CID13150380
Molecular FormulaC8H14N2O
Molecular Weight154.21 g/mol
Exact Mass154.11
IUPAC Name2-ethyl-1-propan-2-ylimidazol-4-ol
SMILESCCc1nc(O)cn1C(C)C
InChIInChI=1S/C8H14N2O/c1-4-7-9-8(11)5-10(7)6(2)3/h5-6,11H,4H2,1-3H3
InChIKeyAZKRXAYDOHPFSI-UHFFFAOYSA-N
XLogP1.73
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.21
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-1-propan-2-ylimidazol-4-ol?
The IUPAC name of 2-ethyl-1-propan-2-ylimidazol-4-ol (CID 13150380) is 2-ethyl-1-propan-2-ylimidazol-4-ol.
What is the SMILES notation for 2-ethyl-1-propan-2-ylimidazol-4-ol?
The canonical SMILES for 2-ethyl-1-propan-2-ylimidazol-4-ol is CCc1nc(O)cn1C(C)C.
What is the InChIKey of 2-ethyl-1-propan-2-ylimidazol-4-ol?
The InChIKey is AZKRXAYDOHPFSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O/c1-4-7-9-8(11)5-10(7)6(2)3/h5-6,11H,4H2,1-3H3.
What are the key properties of 2-ethyl-1-propan-2-ylimidazol-4-ol?
2-ethyl-1-propan-2-ylimidazol-4-ol has a molecular weight of 154.21 g/mol, XLogP of 1.73, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-1-propan-2-ylimidazol-4-ol is sourced from PubChem (CID 13150380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).