2-ethyl-5-methyl-1H-imidazol-4-ol

C6H10N2O — CID 57136495

IUPAC2-ethyl-5-methyl-1H-imidazol-4-ol
SMILESCCc1nc(O)c(C)[nH]1
InChIInChI=1S/C6H10N2O/c1-3-5-7-4(2)6(9)8-5/h9H,3H2,1-2H3,(H,7,8)
InChIKeyMKJKMINCWYQXLP-UHFFFAOYSA-N
MW126.16 g/mol
LogP0.99
Rot. Bonds1

About 2-ethyl-5-methyl-1H-imidazol-4-ol

2-ethyl-5-methyl-1H-imidazol-4-ol (PubChem CID 57136495) has the molecular formula C6H10N2O and a molecular weight of 126.16 g/mol. Its IUPAC name is 2-ethyl-5-methyl-1H-imidazol-4-ol.

Molecular Properties

Compound Name2-ethyl-5-methyl-1H-imidazol-4-ol
PubChem CID57136495
Molecular FormulaC6H10N2O
Molecular Weight126.16 g/mol
Exact Mass126.08
IUPAC Name2-ethyl-5-methyl-1H-imidazol-4-ol
SMILESCCc1nc(O)c(C)[nH]1
InChIInChI=1S/C6H10N2O/c1-3-5-7-4(2)6(9)8-5/h9H,3H2,1-2H3,(H,7,8)
InChIKeyMKJKMINCWYQXLP-UHFFFAOYSA-N
XLogP0.99
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.16
LogP ≤ 50.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-5-methyl-1H-imidazol-4-ol?
The IUPAC name of 2-ethyl-5-methyl-1H-imidazol-4-ol (CID 57136495) is 2-ethyl-5-methyl-1H-imidazol-4-ol.
What is the SMILES notation for 2-ethyl-5-methyl-1H-imidazol-4-ol?
The canonical SMILES for 2-ethyl-5-methyl-1H-imidazol-4-ol is CCc1nc(O)c(C)[nH]1.
What is the InChIKey of 2-ethyl-5-methyl-1H-imidazol-4-ol?
The InChIKey is MKJKMINCWYQXLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2O/c1-3-5-7-4(2)6(9)8-5/h9H,3H2,1-2H3,(H,7,8).
What are the key properties of 2-ethyl-5-methyl-1H-imidazol-4-ol?
2-ethyl-5-methyl-1H-imidazol-4-ol has a molecular weight of 126.16 g/mol, XLogP of 0.99, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-5-methyl-1H-imidazol-4-ol is sourced from PubChem (CID 57136495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).