1-(furan-2-ylmethyl)-2-[5-(1H-pyrazol-5-yl)thiophen-2-yl]imidazole

C15H12N4OS — CID 56748164

IUPAC1-(furan-2-ylmethyl)-2-[5-(1H-pyrazol-5-yl)thiophen-2-yl]imidazole
SMILESc1coc(Cn2ccnc2-c2ccc(-c3ccn[nH]3)s2)c1
InChIInChI=1S/C15H12N4OS/c1-2-11(20-9-1)10-19-8-7-16-15(19)14-4-3-13(21-14)12-5-6-17-18-12/h1-9H,10H2,(H,17,18)
InChIKeyGWKWEWHHJRLNMB-UHFFFAOYSA-N
MW296.36 g/mol
LogP3.64
Rot. Bonds4

About 1-(furan-2-ylmethyl)-2-[5-(1H-pyrazol-5-yl)thiophen-2-yl]imidazole

1-(furan-2-ylmethyl)-2-[5-(1H-pyrazol-5-yl)thiophen-2-yl]imidazole (PubChem CID 56748164) has the molecular formula C15H12N4OS and a molecular weight of 296.36 g/mol. Its IUPAC name is 1-(furan-2-ylmethyl)-2-[5-(1H-pyrazol-5-yl)thiophen-2-yl]imidazole.

Molecular Properties

Compound Name1-(furan-2-ylmethyl)-2-[5-(1H-pyrazol-5-yl)thiophen-2-yl]imidazole
PubChem CID56748164
Molecular FormulaC15H12N4OS
Molecular Weight296.36 g/mol
Exact Mass296.07
IUPAC Name1-(furan-2-ylmethyl)-2-[5-(1H-pyrazol-5-yl)thiophen-2-yl]imidazole
SMILESc1coc(Cn2ccnc2-c2ccc(-c3ccn[nH]3)s2)c1
InChIInChI=1S/C15H12N4OS/c1-2-11(20-9-1)10-19-8-7-16-15(19)14-4-3-13(21-14)12-5-6-17-18-12/h1-9H,10H2,(H,17,18)
InChIKeyGWKWEWHHJRLNMB-UHFFFAOYSA-N
XLogP3.64
TPSA59.64 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.36
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-(5-{1-[3-(1H-imidazol-1-yl)propyl]-1H-imidazol-2-yl}-2-furyl)-1H-pyrazole
CID 56751765
3-imidazol-1-yl-N-[(5-methylfuran-2-yl)methyl]-N-[(5-thiophen-2-yl-1H-pyrazol-4-yl)methyl]propan-1-amine
CID 16676756
3-{5-[1-(2-furylmethyl)-1H-imidazol-2-yl]-2-furyl}-1H-pyrazole
CID 56743515
3,5-dimethyl-1-(2-{2-[5-(1H-pyrazol-3-yl)-2-furyl]-1H-imidazol-1-yl}propyl)-1H-pyrazole
CID 56862617
4-methyl-3-[(2-{2-[5-(1H-pyrazol-3-yl)-2-furyl]-1H-imidazol-1-yl}ethyl)thio]-4H-1,2,4-triazole
CID 56864821
5-{4-[2-(2-furyl)-1H-imidazol-1-yl]phenyl}-1H-pyrazole
CID 56917189
N-(furan-2-ylmethyl)-3-thiophen-2-ylimidazo[1,2-b]pyridazin-6-amine
CID 126475873
5-(2-Furyl)-1-(2-thienylmethyl)-1,4-dihydroimidazo[4,5-c]pyrazole
CID 136014780
2-(furan-2-yl)-5-thiophen-2-yl-1H-imidazole
CID 118521441
2-[4-(furan-2-yl)-2-(1H-pyrazol-5-yl)-1H-imidazol-5-yl]-1,3-thiazole
CID 140993860
4-(furan-2-ylmethyl)-5-(1H-pyrazol-5-ylmethyl)-3-pyrimidin-2-yl-2-(thiophen-2-ylmethyl)-2-(triazin-4-yl)-1,3-oxazole
CID 141003429
5-(furan-2-yl)-3-(1H-imidazol-2-yl)-4-thiophen-2-yl-1H-pyrazole
CID 141042261

Frequently Asked Questions

What is the IUPAC name of 1-(furan-2-ylmethyl)-2-[5-(1H-pyrazol-5-yl)thiophen-2-yl]imidazole?
The IUPAC name of 1-(furan-2-ylmethyl)-2-[5-(1H-pyrazol-5-yl)thiophen-2-yl]imidazole (CID 56748164) is 1-(furan-2-ylmethyl)-2-[5-(1H-pyrazol-5-yl)thiophen-2-yl]imidazole.
What is the SMILES notation for 1-(furan-2-ylmethyl)-2-[5-(1H-pyrazol-5-yl)thiophen-2-yl]imidazole?
The canonical SMILES for 1-(furan-2-ylmethyl)-2-[5-(1H-pyrazol-5-yl)thiophen-2-yl]imidazole is c1coc(Cn2ccnc2-c2ccc(-c3ccn[nH]3)s2)c1.
What is the InChIKey of 1-(furan-2-ylmethyl)-2-[5-(1H-pyrazol-5-yl)thiophen-2-yl]imidazole?
The InChIKey is GWKWEWHHJRLNMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N4OS/c1-2-11(20-9-1)10-19-8-7-16-15(19)14-4-3-13(21-14)12-5-6-17-18-12/h1-9H,10H2,(H,17,18).
What are the key properties of 1-(furan-2-ylmethyl)-2-[5-(1H-pyrazol-5-yl)thiophen-2-yl]imidazole?
1-(furan-2-ylmethyl)-2-[5-(1H-pyrazol-5-yl)thiophen-2-yl]imidazole has a molecular weight of 296.36 g/mol, XLogP of 3.64, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-2-ylmethyl)-2-[5-(1H-pyrazol-5-yl)thiophen-2-yl]imidazole is sourced from PubChem (CID 56748164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).