1-hydroxy-4,5-dihydroimidazole;methane

C4H10N2O — CID 173288195

IUPAC1-hydroxy-4,5-dihydroimidazole;methane
SMILESC.ON1C=NCC1
InChIInChI=1S/C3H6N2O.CH4/c6-5-2-1-4-3-5;/h3,6H,1-2H2;1H4
InChIKeyYQYDYRCWHWAFCI-UHFFFAOYSA-N
MW102.14 g/mol
LogP0.36
Rot. Bonds

About 1-hydroxy-4,5-dihydroimidazole;methane

1-hydroxy-4,5-dihydroimidazole;methane (PubChem CID 173288195) has the molecular formula C4H10N2O and a molecular weight of 102.14 g/mol. Its IUPAC name is 1-hydroxy-4,5-dihydroimidazole;methane.

Molecular Properties

Compound Name1-hydroxy-4,5-dihydroimidazole;methane
PubChem CID173288195
Molecular FormulaC4H10N2O
Molecular Weight102.14 g/mol
Exact Mass102.08
IUPAC Name1-hydroxy-4,5-dihydroimidazole;methane
SMILESC.ON1C=NCC1
InChIInChI=1S/C3H6N2O.CH4/c6-5-2-1-4-3-5;/h3,6H,1-2H2;1H4
InChIKeyYQYDYRCWHWAFCI-UHFFFAOYSA-N
XLogP0.36
TPSA35.83 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500102.14
LogP ≤ 50.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-hydroxy-4,5-dihydroimidazole;methane?
The IUPAC name of 1-hydroxy-4,5-dihydroimidazole;methane (CID 173288195) is 1-hydroxy-4,5-dihydroimidazole;methane.
What is the SMILES notation for 1-hydroxy-4,5-dihydroimidazole;methane?
The canonical SMILES for 1-hydroxy-4,5-dihydroimidazole;methane is C.ON1C=NCC1.
What is the InChIKey of 1-hydroxy-4,5-dihydroimidazole;methane?
The InChIKey is YQYDYRCWHWAFCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H6N2O.CH4/c6-5-2-1-4-3-5;/h3,6H,1-2H2;1H4.
What are the key properties of 1-hydroxy-4,5-dihydroimidazole;methane?
1-hydroxy-4,5-dihydroimidazole;methane has a molecular weight of 102.14 g/mol, XLogP of 0.36, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxy-4,5-dihydroimidazole;methane is sourced from PubChem (CID 173288195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).