5-(furan-2-yl)-3-methyl-2-phenyl-1H-pyrrole

C15H13NO — CID 134968569

IUPAC5-(furan-2-yl)-3-methyl-2-phenyl-1H-pyrrole
SMILESCc1cc(-c2ccco2)[nH]c1-c1ccccc1
InChIInChI=1S/C15H13NO/c1-11-10-13(14-8-5-9-17-14)16-15(11)12-6-3-2-4-7-12/h2-10,16H,1H3
InChIKeyPDZLGOAXLKLLKS-UHFFFAOYSA-N
MW223.28 g/mol
LogP4.25
Rot. Bonds2

About 5-(furan-2-yl)-3-methyl-2-phenyl-1H-pyrrole

5-(furan-2-yl)-3-methyl-2-phenyl-1H-pyrrole (PubChem CID 134968569) has the molecular formula C15H13NO and a molecular weight of 223.28 g/mol. Its IUPAC name is 5-(furan-2-yl)-3-methyl-2-phenyl-1H-pyrrole.

Molecular Properties

Compound Name5-(furan-2-yl)-3-methyl-2-phenyl-1H-pyrrole
PubChem CID134968569
Molecular FormulaC15H13NO
Molecular Weight223.28 g/mol
Exact Mass223.10
IUPAC Name5-(furan-2-yl)-3-methyl-2-phenyl-1H-pyrrole
SMILESCc1cc(-c2ccco2)[nH]c1-c1ccccc1
InChIInChI=1S/C15H13NO/c1-11-10-13(14-8-5-9-17-14)16-15(11)12-6-3-2-4-7-12/h2-10,16H,1H3
InChIKeyPDZLGOAXLKLLKS-UHFFFAOYSA-N
XLogP4.25
TPSA28.93 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 54.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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4-methyl-5-phenyl-1H-pyrrol-2-ol
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6-(furan-2-yl)-5-methyl-2-oxo-1H-pyridine-3-carboxylic acid
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2-(furan-2-yl)-5-methyl-4-phenyl-1H-imidazole
CID 73335465
methyl 4-(4-methyl-5-phenyl-1H-pyrrol-2-yl)benzoate
CID 177440288
2-phenylfuran;piperazine
CID 68614405
2-benzyl-5-(furan-2-yl)-1H-pyrrole
CID 70680081
4-(3,4-dimethylphenyl)-3-(furan-2-yl)-5-phenyl-1,2,4-triazole
CID 1289597
7-fluoro-2-(furan-2-yl)-1H-indole
CID 131868388
2-(4-chloro-3,5-dimethylphenyl)furan
CID 168527809
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Frequently Asked Questions

What is the IUPAC name of 5-(furan-2-yl)-3-methyl-2-phenyl-1H-pyrrole?
The IUPAC name of 5-(furan-2-yl)-3-methyl-2-phenyl-1H-pyrrole (CID 134968569) is 5-(furan-2-yl)-3-methyl-2-phenyl-1H-pyrrole.
What is the SMILES notation for 5-(furan-2-yl)-3-methyl-2-phenyl-1H-pyrrole?
The canonical SMILES for 5-(furan-2-yl)-3-methyl-2-phenyl-1H-pyrrole is Cc1cc(-c2ccco2)[nH]c1-c1ccccc1.
What is the InChIKey of 5-(furan-2-yl)-3-methyl-2-phenyl-1H-pyrrole?
The InChIKey is PDZLGOAXLKLLKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13NO/c1-11-10-13(14-8-5-9-17-14)16-15(11)12-6-3-2-4-7-12/h2-10,16H,1H3.
What are the key properties of 5-(furan-2-yl)-3-methyl-2-phenyl-1H-pyrrole?
5-(furan-2-yl)-3-methyl-2-phenyl-1H-pyrrole has a molecular weight of 223.28 g/mol, XLogP of 4.25, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(furan-2-yl)-3-methyl-2-phenyl-1H-pyrrole is sourced from PubChem (CID 134968569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).