1-N-(4-fluorophenyl)-2-phenyl-2,3-dihydroimidazo[2,1-e]pyrazole-1,7-dicarboxamide

C19H16FN5O2 — CID 56971037

IUPAC1-N-(4-fluorophenyl)-2-phenyl-2,3-dihydroimidazo[2,1-e]pyrazole-1,7-dicarboxamide
SMILESNC(=O)c1cnn2c1N(C(=O)Nc1ccc(F)cc1)C(c1ccccc1)C2
InChIInChI=1S/C19H16FN5O2/c20-13-6-8-14(9-7-13)23-19(27)25-16(12-4-2-1-3-5-12)11-24-18(25)15(10-22-24)17(21)26/h1-10,16H,11H2,(H2,21,26)(H,23,27)
InChIKeyGPJAUDCTMZIHIN-UHFFFAOYSA-N
MW365.37 g/mol
LogP2.91
Rot. Bonds3

About 1-N-(4-fluorophenyl)-2-phenyl-2,3-dihydroimidazo[2,1-e]pyrazole-1,7-dicarboxamide

1-N-(4-fluorophenyl)-2-phenyl-2,3-dihydroimidazo[2,1-e]pyrazole-1,7-dicarboxamide (PubChem CID 56971037) has the molecular formula C19H16FN5O2 and a molecular weight of 365.37 g/mol. Its IUPAC name is 1-N-(4-fluorophenyl)-2-phenyl-2,3-dihydroimidazo[2,1-e]pyrazole-1,7-dicarboxamide.

Molecular Properties

Compound Name1-N-(4-fluorophenyl)-2-phenyl-2,3-dihydroimidazo[2,1-e]pyrazole-1,7-dicarboxamide
PubChem CID56971037
Molecular FormulaC19H16FN5O2
Molecular Weight365.37 g/mol
Exact Mass365.13
IUPAC Name1-N-(4-fluorophenyl)-2-phenyl-2,3-dihydroimidazo[2,1-e]pyrazole-1,7-dicarboxamide
SMILESNC(=O)c1cnn2c1N(C(=O)Nc1ccc(F)cc1)C(c1ccccc1)C2
InChIInChI=1S/C19H16FN5O2/c20-13-6-8-14(9-7-13)23-19(27)25-16(12-4-2-1-3-5-12)11-24-18(25)15(10-22-24)17(21)26/h1-10,16H,11H2,(H2,21,26)(H,23,27)
InChIKeyGPJAUDCTMZIHIN-UHFFFAOYSA-N
XLogP2.91
TPSA93.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.37
LogP ≤ 52.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-N-(4-fluorophenyl)-2-phenyl-2,3-dihydroimidazo[2,1-e]pyrazole-1,7-dicarboxamide?
The IUPAC name of 1-N-(4-fluorophenyl)-2-phenyl-2,3-dihydroimidazo[2,1-e]pyrazole-1,7-dicarboxamide (CID 56971037) is 1-N-(4-fluorophenyl)-2-phenyl-2,3-dihydroimidazo[2,1-e]pyrazole-1,7-dicarboxamide.
What is the SMILES notation for 1-N-(4-fluorophenyl)-2-phenyl-2,3-dihydroimidazo[2,1-e]pyrazole-1,7-dicarboxamide?
The canonical SMILES for 1-N-(4-fluorophenyl)-2-phenyl-2,3-dihydroimidazo[2,1-e]pyrazole-1,7-dicarboxamide is NC(=O)c1cnn2c1N(C(=O)Nc1ccc(F)cc1)C(c1ccccc1)C2.
What is the InChIKey of 1-N-(4-fluorophenyl)-2-phenyl-2,3-dihydroimidazo[2,1-e]pyrazole-1,7-dicarboxamide?
The InChIKey is GPJAUDCTMZIHIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16FN5O2/c20-13-6-8-14(9-7-13)23-19(27)25-16(12-4-2-1-3-5-12)11-24-18(25)15(10-22-24)17(21)26/h1-10,16H,11H2,(H2,21,26)(H,23,27).
What are the key properties of 1-N-(4-fluorophenyl)-2-phenyl-2,3-dihydroimidazo[2,1-e]pyrazole-1,7-dicarboxamide?
1-N-(4-fluorophenyl)-2-phenyl-2,3-dihydroimidazo[2,1-e]pyrazole-1,7-dicarboxamide has a molecular weight of 365.37 g/mol, XLogP of 2.91, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-(4-fluorophenyl)-2-phenyl-2,3-dihydroimidazo[2,1-e]pyrazole-1,7-dicarboxamide is sourced from PubChem (CID 56971037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).