5-[3-[5-(5-methylfuran-2-yl)-4-phenylimidazol-1-yl]propyl]-1,3,4-thiadiazol-2-amine

C19H19N5OS — CID 50960079

IUPAC5-[3-[5-(5-methylfuran-2-yl)-4-phenylimidazol-1-yl]propyl]-1,3,4-thiadiazol-2-amine
SMILESCc1ccc(-c2c(-c3ccccc3)ncn2CCCc2nnc(N)s2)o1
InChIInChI=1S/C19H19N5OS/c1-13-9-10-15(25-13)18-17(14-6-3-2-4-7-14)21-12-24(18)11-5-8-16-22-23-19(20)26-16/h2-4,6-7,9-10,12H,5,8,11H2,1H3,(H2,20,23)
InChIKeyRGCSOJGMTOKCEZ-UHFFFAOYSA-N
MW365.46 g/mol
LogP4.19
Rot. Bonds6

About 5-[3-[5-(5-methylfuran-2-yl)-4-phenylimidazol-1-yl]propyl]-1,3,4-thiadiazol-2-amine

5-[3-[5-(5-methylfuran-2-yl)-4-phenylimidazol-1-yl]propyl]-1,3,4-thiadiazol-2-amine (PubChem CID 50960079) has the molecular formula C19H19N5OS and a molecular weight of 365.46 g/mol. Its IUPAC name is 5-[3-[5-(5-methylfuran-2-yl)-4-phenylimidazol-1-yl]propyl]-1,3,4-thiadiazol-2-amine.

Molecular Properties

Compound Name5-[3-[5-(5-methylfuran-2-yl)-4-phenylimidazol-1-yl]propyl]-1,3,4-thiadiazol-2-amine
PubChem CID50960079
Molecular FormulaC19H19N5OS
Molecular Weight365.46 g/mol
Exact Mass365.13
IUPAC Name5-[3-[5-(5-methylfuran-2-yl)-4-phenylimidazol-1-yl]propyl]-1,3,4-thiadiazol-2-amine
SMILESCc1ccc(-c2c(-c3ccccc3)ncn2CCCc2nnc(N)s2)o1
InChIInChI=1S/C19H19N5OS/c1-13-9-10-15(25-13)18-17(14-6-3-2-4-7-14)21-12-24(18)11-5-8-16-22-23-19(20)26-16/h2-4,6-7,9-10,12H,5,8,11H2,1H3,(H2,20,23)
InChIKeyRGCSOJGMTOKCEZ-UHFFFAOYSA-N
XLogP4.19
TPSA82.76 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.46
LogP ≤ 54.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 5-[3-[5-(5-methylfuran-2-yl)-4-phenylimidazol-1-yl]propyl]-1,3,4-thiadiazol-2-amine with MolForge

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Related Compounds

4-(4-fluorophenyl)-1-[2-[2-[4-(4-fluorophenyl)-5-(5-methylfuran-2-yl)imidazol-1-yl]ethyldisulfanyl]ethyl]-5-(5-methylfuran-2-yl)imidazole
CID 10651259
4-[[5-(5-ethylfuran-2-yl)-4-phenylimidazol-1-yl]methyl]-1,3-thiazol-2-amine
CID 50958331
4,5-diphenyl-1-propylimidazole
CID 14950648
2-(3-butyl-5-phenylimidazol-4-yl)-[1,3]thiazolo[5,4-d]pyrimidin-7-amine
CID 10405619
2-[4-(3-butyl-5-phenylimidazol-4-yl)phenoxy]acetamide
CID 50984888
4-[3-[4-(methylamino)butyl]-5-phenylimidazol-4-yl]phenol
CID 50978507
3-[5-(3-methyl-1,2-oxazol-5-yl)-4-phenylimidazol-1-yl]propanoic acid
CID 70783823
1-[3-(3-ethoxypropoxy)propyl]-4,5-diphenylimidazole
CID 10133391
4-[2-[5-(1,3-dimethylpyrazol-4-yl)-4-phenylimidazol-1-yl]ethyl]-1,3-thiazol-2-amine
CID 50955094
2-methyl-5-[[4-phenyl-5-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]methyl]pyrazine
CID 50952225
2-[5-(5-methyl-2-phenyl-1,3-oxazol-4-yl)-4-phenylimidazol-1-yl]ethanol
CID 50953740
[5-[3-[2-(1-methyltetrazol-5-yl)sulfanylethyl]-5-phenylimidazol-4-yl]furan-2-yl]methanol
CID 50974446

Frequently Asked Questions

What is the IUPAC name of 5-[3-[5-(5-methylfuran-2-yl)-4-phenylimidazol-1-yl]propyl]-1,3,4-thiadiazol-2-amine?
The IUPAC name of 5-[3-[5-(5-methylfuran-2-yl)-4-phenylimidazol-1-yl]propyl]-1,3,4-thiadiazol-2-amine (CID 50960079) is 5-[3-[5-(5-methylfuran-2-yl)-4-phenylimidazol-1-yl]propyl]-1,3,4-thiadiazol-2-amine.
What is the SMILES notation for 5-[3-[5-(5-methylfuran-2-yl)-4-phenylimidazol-1-yl]propyl]-1,3,4-thiadiazol-2-amine?
The canonical SMILES for 5-[3-[5-(5-methylfuran-2-yl)-4-phenylimidazol-1-yl]propyl]-1,3,4-thiadiazol-2-amine is Cc1ccc(-c2c(-c3ccccc3)ncn2CCCc2nnc(N)s2)o1.
What is the InChIKey of 5-[3-[5-(5-methylfuran-2-yl)-4-phenylimidazol-1-yl]propyl]-1,3,4-thiadiazol-2-amine?
The InChIKey is RGCSOJGMTOKCEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N5OS/c1-13-9-10-15(25-13)18-17(14-6-3-2-4-7-14)21-12-24(18)11-5-8-16-22-23-19(20)26-16/h2-4,6-7,9-10,12H,5,8,11H2,1H3,(H2,20,23).
What are the key properties of 5-[3-[5-(5-methylfuran-2-yl)-4-phenylimidazol-1-yl]propyl]-1,3,4-thiadiazol-2-amine?
5-[3-[5-(5-methylfuran-2-yl)-4-phenylimidazol-1-yl]propyl]-1,3,4-thiadiazol-2-amine has a molecular weight of 365.46 g/mol, XLogP of 4.19, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[3-[5-(5-methylfuran-2-yl)-4-phenylimidazol-1-yl]propyl]-1,3,4-thiadiazol-2-amine is sourced from PubChem (CID 50960079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).