furan;1H-imidazole;1H-pyrazole;1H-pyrrole;thiophene

C18H21N5OS — CID 67067519

IUPACfuran;1H-imidazole;1H-pyrazole;1H-pyrrole;thiophene
SMILESc1c[nH]cn1.c1cc[nH]c1.c1ccoc1.c1ccsc1.c1cn[nH]c1
InChIInChI=1S/C4H5N.C4H4O.C4H4S.2C3H4N2/c3*1-2-4-5-3-1;1-2-5-3-4-1;1-2-4-5-3-1/h1-5H;2*1-4H;2*1-3H,(H,4,5)
InChIKeyCMTVYONOFRUKSQ-UHFFFAOYSA-N
MW355.47 g/mol
LogP4.86
Rot. Bonds

About furan;1H-imidazole;1H-pyrazole;1H-pyrrole;thiophene

furan;1H-imidazole;1H-pyrazole;1H-pyrrole;thiophene (PubChem CID 67067519) has the molecular formula C18H21N5OS and a molecular weight of 355.47 g/mol. Its IUPAC name is furan;1H-imidazole;1H-pyrazole;1H-pyrrole;thiophene.

Molecular Properties

Compound Namefuran;1H-imidazole;1H-pyrazole;1H-pyrrole;thiophene
PubChem CID67067519
Molecular FormulaC18H21N5OS
Molecular Weight355.47 g/mol
Exact Mass355.15
IUPAC Namefuran;1H-imidazole;1H-pyrazole;1H-pyrrole;thiophene
SMILESc1c[nH]cn1.c1cc[nH]c1.c1ccoc1.c1ccsc1.c1cn[nH]c1
InChIInChI=1S/C4H5N.C4H4O.C4H4S.2C3H4N2/c3*1-2-4-5-3-1;1-2-5-3-4-1;1-2-4-5-3-1/h1-5H;2*1-4H;2*1-3H,(H,4,5)
InChIKeyCMTVYONOFRUKSQ-UHFFFAOYSA-N
XLogP4.86
TPSA86.29 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.47
LogP ≤ 54.86
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of furan;1H-imidazole;1H-pyrazole;1H-pyrrole;thiophene?
The IUPAC name of furan;1H-imidazole;1H-pyrazole;1H-pyrrole;thiophene (CID 67067519) is furan;1H-imidazole;1H-pyrazole;1H-pyrrole;thiophene.
What is the SMILES notation for furan;1H-imidazole;1H-pyrazole;1H-pyrrole;thiophene?
The canonical SMILES for furan;1H-imidazole;1H-pyrazole;1H-pyrrole;thiophene is c1c[nH]cn1.c1cc[nH]c1.c1ccoc1.c1ccsc1.c1cn[nH]c1.
What is the InChIKey of furan;1H-imidazole;1H-pyrazole;1H-pyrrole;thiophene?
The InChIKey is CMTVYONOFRUKSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H5N.C4H4O.C4H4S.2C3H4N2/c3*1-2-4-5-3-1;1-2-5-3-4-1;1-2-4-5-3-1/h1-5H;2*1-4H;2*1-3H,(H,4,5).
What are the key properties of furan;1H-imidazole;1H-pyrazole;1H-pyrrole;thiophene?
furan;1H-imidazole;1H-pyrazole;1H-pyrrole;thiophene has a molecular weight of 355.47 g/mol, XLogP of 4.86, 0 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for furan;1H-imidazole;1H-pyrazole;1H-pyrrole;thiophene is sourced from PubChem (CID 67067519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).