ethane;1-(methoxymethyl)imidazole

C7H14N2O — CID 91425375

IUPACethane;1-(methoxymethyl)imidazole
SMILESCC.COCn1ccnc1
InChIInChI=1S/C5H8N2O.C2H6/c1-8-5-7-3-2-6-4-7;1-2/h2-4H,5H2,1H3;1-2H3
InChIKeyMGQJETQOABBGLG-UHFFFAOYSA-N
MW142.20 g/mol
LogP1.51
Rot. Bonds2

About ethane;1-(methoxymethyl)imidazole

ethane;1-(methoxymethyl)imidazole (PubChem CID 91425375) has the molecular formula C7H14N2O and a molecular weight of 142.20 g/mol. Its IUPAC name is ethane;1-(methoxymethyl)imidazole.

Molecular Properties

Compound Nameethane;1-(methoxymethyl)imidazole
PubChem CID91425375
Molecular FormulaC7H14N2O
Molecular Weight142.20 g/mol
Exact Mass142.11
IUPAC Nameethane;1-(methoxymethyl)imidazole
SMILESCC.COCn1ccnc1
InChIInChI=1S/C5H8N2O.C2H6/c1-8-5-7-3-2-6-4-7;1-2/h2-4H,5H2,1H3;1-2H3
InChIKeyMGQJETQOABBGLG-UHFFFAOYSA-N
XLogP1.51
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 51.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-methoxyethyl)imidazole
CID 14366840
imidazol-1-ylmethyl methyl sulfate
CID 134349916
1-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]imidazole
CID 66705550
2-(imidazol-1-ylmethoxy)ethyl-trimethylsilane
CID 11052605
1-(imidazol-1-ylmethoxy)ethyl-trimethylsilane
CID 19348104
1-(2,2-dimethoxyethyl)imidazole
CID 12922722
1-ethylimidazole;hydroiodide
CID 66751695
copper;1-ethylimidazole
CID 118057388
1-(dodecoxymethyl)imidazole
CID 102264585
1-[(4-methylphenoxy)methyl]imidazole
CID 15555875
4-(methoxymethyl)-1,2,4-triazole
CID 57102557
1-[[3,5-bis(imidazol-1-ylmethyl)-2,4,6-trimethoxyphenyl]methyl]imidazole
CID 102363409

Frequently Asked Questions

What is the IUPAC name of ethane;1-(methoxymethyl)imidazole?
The IUPAC name of ethane;1-(methoxymethyl)imidazole (CID 91425375) is ethane;1-(methoxymethyl)imidazole.
What is the SMILES notation for ethane;1-(methoxymethyl)imidazole?
The canonical SMILES for ethane;1-(methoxymethyl)imidazole is CC.COCn1ccnc1.
What is the InChIKey of ethane;1-(methoxymethyl)imidazole?
The InChIKey is MGQJETQOABBGLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N2O.C2H6/c1-8-5-7-3-2-6-4-7;1-2/h2-4H,5H2,1H3;1-2H3.
What are the key properties of ethane;1-(methoxymethyl)imidazole?
ethane;1-(methoxymethyl)imidazole has a molecular weight of 142.20 g/mol, XLogP of 1.51, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1-(methoxymethyl)imidazole is sourced from PubChem (CID 91425375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).