4,6-dihydro-1H-furo[3,4-d]imidazole

C5H6N2O — CID 45120722

IUPAC4,6-dihydro-1H-furo[3,4-d]imidazole
SMILESc1nc2c([nH]1)COC2
InChIInChI=1S/C5H6N2O/c1-4-5(2-8-1)7-3-6-4/h3H,1-2H2,(H,6,7)
InChIKeyZMMLPPGOGZIKID-UHFFFAOYSA-N
MW110.12 g/mol
LogP0.44
Rot. Bonds

About 4,6-dihydro-1H-furo[3,4-d]imidazole

4,6-dihydro-1H-furo[3,4-d]imidazole (PubChem CID 45120722) has the molecular formula C5H6N2O and a molecular weight of 110.12 g/mol. Its IUPAC name is 4,6-dihydro-1H-furo[3,4-d]imidazole.

Molecular Properties

Compound Name4,6-dihydro-1H-furo[3,4-d]imidazole
PubChem CID45120722
Molecular FormulaC5H6N2O
Molecular Weight110.12 g/mol
Exact Mass110.05
IUPAC Name4,6-dihydro-1H-furo[3,4-d]imidazole
SMILESc1nc2c([nH]1)COC2
InChIInChI=1S/C5H6N2O/c1-4-5(2-8-1)7-3-6-4/h3H,1-2H2,(H,6,7)
InChIKeyZMMLPPGOGZIKID-UHFFFAOYSA-N
XLogP0.44
TPSA37.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500110.12
LogP ≤ 50.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 12362436
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Ethanamine, 2-((5-methyl-1H-imidazol-4-yl)methoxy)-
CID 157952
4-fluoro-5-(methoxymethyl)-1H-imidazole
CID 55288406
4-(methoxymethyl)-5-methyl-1H-imidazole;hydrochloride
CID 12885467
(5-methyl-1H-imidazol-4-yl)methyl N-methylcarbamate
CID 13236491
4-(ethoxymethyl)-5-methyl-1H-imidazole;hydrochloride
CID 20331729
4-(ethoxymethyl)-5-methyl-1H-imidazole
CID 20331730
(5-methyl-1H-imidazol-4-yl)methyl acetate
CID 20463580
3-[(5-methyl-1H-imidazol-4-yl)methoxy]propanenitrile
CID 20505223
ethyl 3-[(5-methyl-1H-imidazol-4-yl)methoxy]propanimidate
CID 20505227
N'-cyano-3-[(5-methyl-1H-imidazol-4-yl)methoxy]propanimidamide
CID 20505235

Frequently Asked Questions

What is the IUPAC name of 4,6-dihydro-1H-furo[3,4-d]imidazole?
The IUPAC name of 4,6-dihydro-1H-furo[3,4-d]imidazole (CID 45120722) is 4,6-dihydro-1H-furo[3,4-d]imidazole.
What is the SMILES notation for 4,6-dihydro-1H-furo[3,4-d]imidazole?
The canonical SMILES for 4,6-dihydro-1H-furo[3,4-d]imidazole is c1nc2c([nH]1)COC2.
What is the InChIKey of 4,6-dihydro-1H-furo[3,4-d]imidazole?
The InChIKey is ZMMLPPGOGZIKID-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6N2O/c1-4-5(2-8-1)7-3-6-4/h3H,1-2H2,(H,6,7).
What are the key properties of 4,6-dihydro-1H-furo[3,4-d]imidazole?
4,6-dihydro-1H-furo[3,4-d]imidazole has a molecular weight of 110.12 g/mol, XLogP of 0.44, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dihydro-1H-furo[3,4-d]imidazole is sourced from PubChem (CID 45120722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).