(3R)-3-(furan-2-yl)-5-[(E)-2-(furan-2-yl)ethenyl]-2-phenyl-3,4-dihydropyrazole

C19H16N2O2 — CID 898950

IUPAC(3R)-3-(furan-2-yl)-5-[(E)-2-(furan-2-yl)ethenyl]-2-phenyl-3,4-dihydropyrazole
SMILESC(=C/c1ccco1)\C1=NN(c2ccccc2)[C@@H](c2ccco2)C1
InChIInChI=1S/C19H16N2O2/c1-2-6-16(7-3-1)21-18(19-9-5-13-23-19)14-15(20-21)10-11-17-8-4-12-22-17/h1-13,18H,14H2/b11-10+/t18-/m1/s1
InChIKeyVLTZONYFQFOYOS-DOJUMQAQSA-N
MW304.35 g/mol
LogP4.89
Rot. Bonds4

About (3R)-3-(furan-2-yl)-5-[(E)-2-(furan-2-yl)ethenyl]-2-phenyl-3,4-dihydropyrazole

(3R)-3-(furan-2-yl)-5-[(E)-2-(furan-2-yl)ethenyl]-2-phenyl-3,4-dihydropyrazole (PubChem CID 898950) has the molecular formula C19H16N2O2 and a molecular weight of 304.35 g/mol. Its IUPAC name is (3R)-3-(furan-2-yl)-5-[(E)-2-(furan-2-yl)ethenyl]-2-phenyl-3,4-dihydropyrazole.

Molecular Properties

Compound Name(3R)-3-(furan-2-yl)-5-[(E)-2-(furan-2-yl)ethenyl]-2-phenyl-3,4-dihydropyrazole
PubChem CID898950
Molecular FormulaC19H16N2O2
Molecular Weight304.35 g/mol
Exact Mass304.12
IUPAC Name(3R)-3-(furan-2-yl)-5-[(E)-2-(furan-2-yl)ethenyl]-2-phenyl-3,4-dihydropyrazole
SMILESC(=C/c1ccco1)\C1=NN(c2ccccc2)[C@@H](c2ccco2)C1
InChIInChI=1S/C19H16N2O2/c1-2-6-16(7-3-1)21-18(19-9-5-13-23-19)14-15(20-21)10-11-17-8-4-12-22-17/h1-13,18H,14H2/b11-10+/t18-/m1/s1
InChIKeyVLTZONYFQFOYOS-DOJUMQAQSA-N
XLogP4.89
TPSA41.88 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.35
LogP ≤ 54.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze (3R)-3-(furan-2-yl)-5-[(E)-2-(furan-2-yl)ethenyl]-2-phenyl-3,4-dihydropyrazole with MolForge

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Related Compounds

(3S)-3-(furan-2-yl)-5-[(Z)-2-(4-nitrophenyl)ethenyl]-2-phenyl-3,4-dihydropyrazole
CID 99901379
5-[5-[(E)-2-(4-chlorophenyl)ethenyl]furan-2-yl]-3-(furan-2-yl)-2-phenyl-3,4-dihydropyrazole
CID 14870885
(3R)-3-(4-chlorophenyl)-5-[(E)-2-(4-chlorophenyl)ethenyl]-2-phenyl-3,4-dihydropyrazole
CID 7329476
3-[3-(furan-2-yl)-2-phenyl-3,4-dihydropyrazol-5-yl]chromen-2-one
CID 5115349
5-tert-butyl-1-[4-[3-(furan-2-yl)-2-phenyl-3,4-dihydropyrazol-5-yl]phenyl]triazole
CID 5021333
(3R)-3-(furan-2-yl)-2-(4-nitrophenyl)-5-phenyl-3,4-dihydropyrazole
CID 95989229
(3S)-3-(4-methoxyphenyl)-5-[(Z)-2-(4-methoxyphenyl)ethenyl]-2-phenyl-3,4-dihydropyrazole
CID 92909932
2-[(E)-2-phenylethenyl]furan
CID 642118
(2R,5R)-5-(furan-2-yl)-1,2-diphenylpyrrolidin-3-one
CID 11197439
4-[5-[2-(4-tert-butylphenyl)ethenyl]-2-phenyl-3,4-dihydropyrazol-3-yl]aniline
CID 69048476
N,N-diethyl-4-[2-(9-ethylcarbazol-1-yl)-5-[2-(furan-2-yl)ethenyl]-3,4-dihydropyrazol-3-yl]aniline
CID 54109261
3-(furan-2-yl)-2-(4-methylsulfonylphenyl)-3,4-dihydropyrazole-5-carboxylic acid
CID 127041578

Frequently Asked Questions

What is the IUPAC name of (3R)-3-(furan-2-yl)-5-[(E)-2-(furan-2-yl)ethenyl]-2-phenyl-3,4-dihydropyrazole?
The IUPAC name of (3R)-3-(furan-2-yl)-5-[(E)-2-(furan-2-yl)ethenyl]-2-phenyl-3,4-dihydropyrazole (CID 898950) is (3R)-3-(furan-2-yl)-5-[(E)-2-(furan-2-yl)ethenyl]-2-phenyl-3,4-dihydropyrazole.
What is the SMILES notation for (3R)-3-(furan-2-yl)-5-[(E)-2-(furan-2-yl)ethenyl]-2-phenyl-3,4-dihydropyrazole?
The canonical SMILES for (3R)-3-(furan-2-yl)-5-[(E)-2-(furan-2-yl)ethenyl]-2-phenyl-3,4-dihydropyrazole is C(=C/c1ccco1)\C1=NN(c2ccccc2)[C@@H](c2ccco2)C1.
What is the InChIKey of (3R)-3-(furan-2-yl)-5-[(E)-2-(furan-2-yl)ethenyl]-2-phenyl-3,4-dihydropyrazole?
The InChIKey is VLTZONYFQFOYOS-DOJUMQAQSA-N. The full InChI is InChI=1S/C19H16N2O2/c1-2-6-16(7-3-1)21-18(19-9-5-13-23-19)14-15(20-21)10-11-17-8-4-12-22-17/h1-13,18H,14H2/b11-10+/t18-/m1/s1.
What are the key properties of (3R)-3-(furan-2-yl)-5-[(E)-2-(furan-2-yl)ethenyl]-2-phenyl-3,4-dihydropyrazole?
(3R)-3-(furan-2-yl)-5-[(E)-2-(furan-2-yl)ethenyl]-2-phenyl-3,4-dihydropyrazole has a molecular weight of 304.35 g/mol, XLogP of 4.89, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-(furan-2-yl)-5-[(E)-2-(furan-2-yl)ethenyl]-2-phenyl-3,4-dihydropyrazole is sourced from PubChem (CID 898950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).