5-(furan-2-yl)-1-[(1R)-1-(2-methylpyrazol-3-yl)propyl]-4-phenylimidazole

C20H20N4O — CID 95123632

IUPAC5-(furan-2-yl)-1-[(1R)-1-(2-methylpyrazol-3-yl)propyl]-4-phenylimidazole
SMILESCC[C@H](c1ccnn1C)n1cnc(-c2ccccc2)c1-c1ccco1
InChIInChI=1S/C20H20N4O/c1-3-16(17-11-12-22-23(17)2)24-14-21-19(15-8-5-4-6-9-15)20(24)18-10-7-13-25-18/h4-14,16H,3H2,1-2H3/t16-/m1/s1
InChIKeyYVPKOQLIJRTPRF-MRXNPFEDSA-N
MW332.41 g/mol
LogP4.54
Rot. Bonds5

About 5-(furan-2-yl)-1-[(1R)-1-(2-methylpyrazol-3-yl)propyl]-4-phenylimidazole

5-(furan-2-yl)-1-[(1R)-1-(2-methylpyrazol-3-yl)propyl]-4-phenylimidazole (PubChem CID 95123632) has the molecular formula C20H20N4O and a molecular weight of 332.41 g/mol. Its IUPAC name is 5-(furan-2-yl)-1-[(1R)-1-(2-methylpyrazol-3-yl)propyl]-4-phenylimidazole.

Molecular Properties

Compound Name5-(furan-2-yl)-1-[(1R)-1-(2-methylpyrazol-3-yl)propyl]-4-phenylimidazole
PubChem CID95123632
Molecular FormulaC20H20N4O
Molecular Weight332.41 g/mol
Exact Mass332.16
IUPAC Name5-(furan-2-yl)-1-[(1R)-1-(2-methylpyrazol-3-yl)propyl]-4-phenylimidazole
SMILESCC[C@H](c1ccnn1C)n1cnc(-c2ccccc2)c1-c1ccco1
InChIInChI=1S/C20H20N4O/c1-3-16(17-11-12-22-23(17)2)24-14-21-19(15-8-5-4-6-9-15)20(24)18-10-7-13-25-18/h4-14,16H,3H2,1-2H3/t16-/m1/s1
InChIKeyYVPKOQLIJRTPRF-MRXNPFEDSA-N
XLogP4.54
TPSA48.78 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.41
LogP ≤ 54.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-(furan-2-yl)-1-[(1R)-1-(2-methylpyrazol-3-yl)propyl]-4-phenylimidazole?
The IUPAC name of 5-(furan-2-yl)-1-[(1R)-1-(2-methylpyrazol-3-yl)propyl]-4-phenylimidazole (CID 95123632) is 5-(furan-2-yl)-1-[(1R)-1-(2-methylpyrazol-3-yl)propyl]-4-phenylimidazole.
What is the SMILES notation for 5-(furan-2-yl)-1-[(1R)-1-(2-methylpyrazol-3-yl)propyl]-4-phenylimidazole?
The canonical SMILES for 5-(furan-2-yl)-1-[(1R)-1-(2-methylpyrazol-3-yl)propyl]-4-phenylimidazole is CC[C@H](c1ccnn1C)n1cnc(-c2ccccc2)c1-c1ccco1.
What is the InChIKey of 5-(furan-2-yl)-1-[(1R)-1-(2-methylpyrazol-3-yl)propyl]-4-phenylimidazole?
The InChIKey is YVPKOQLIJRTPRF-MRXNPFEDSA-N. The full InChI is InChI=1S/C20H20N4O/c1-3-16(17-11-12-22-23(17)2)24-14-21-19(15-8-5-4-6-9-15)20(24)18-10-7-13-25-18/h4-14,16H,3H2,1-2H3/t16-/m1/s1.
What are the key properties of 5-(furan-2-yl)-1-[(1R)-1-(2-methylpyrazol-3-yl)propyl]-4-phenylimidazole?
5-(furan-2-yl)-1-[(1R)-1-(2-methylpyrazol-3-yl)propyl]-4-phenylimidazole has a molecular weight of 332.41 g/mol, XLogP of 4.54, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(furan-2-yl)-1-[(1R)-1-(2-methylpyrazol-3-yl)propyl]-4-phenylimidazole is sourced from PubChem (CID 95123632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).