(3R)-5-methyl-2,3-diphenyl-3,4-dihydropyrazole

C16H16N2 — CID 684236

IUPAC(3R)-5-methyl-2,3-diphenyl-3,4-dihydropyrazole
SMILESCC1=NN(c2ccccc2)[C@@H](c2ccccc2)C1
InChIInChI=1S/C16H16N2/c1-13-12-16(14-8-4-2-5-9-14)18(17-13)15-10-6-3-7-11-15/h2-11,16H,12H2,1H3/t16-/m1/s1
InChIKeyFZTOIOYDPXSQDM-MRXNPFEDSA-N
MW236.32 g/mol
LogP4.01
Rot. Bonds2

About (3R)-5-methyl-2,3-diphenyl-3,4-dihydropyrazole

(3R)-5-methyl-2,3-diphenyl-3,4-dihydropyrazole (PubChem CID 684236) has the molecular formula C16H16N2 and a molecular weight of 236.32 g/mol. Its IUPAC name is (3R)-5-methyl-2,3-diphenyl-3,4-dihydropyrazole.

Molecular Properties

Compound Name(3R)-5-methyl-2,3-diphenyl-3,4-dihydropyrazole
PubChem CID684236
Molecular FormulaC16H16N2
Molecular Weight236.32 g/mol
Exact Mass236.13
IUPAC Name(3R)-5-methyl-2,3-diphenyl-3,4-dihydropyrazole
SMILESCC1=NN(c2ccccc2)[C@@H](c2ccccc2)C1
InChIInChI=1S/C16H16N2/c1-13-12-16(14-8-4-2-5-9-14)18(17-13)15-10-6-3-7-11-15/h2-11,16H,12H2,1H3/t16-/m1/s1
InChIKeyFZTOIOYDPXSQDM-MRXNPFEDSA-N
XLogP4.01
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 54.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(3S)-3-(4-chlorophenyl)-5-methyl-2-phenyl-3,4-dihydropyrazole
CID 102160984
(3S)-3-(3-fluorophenyl)-5-methyl-2-phenyl-3,4-dihydropyrazole
CID 102160988
[4-(5-methyl-2-phenyl-3,4-dihydropyrazol-3-yl)phenyl]methanesulfinate
CID 174449441
2,3-bis(4-chlorophenyl)-5-methyl-3,4-dihydropyrazole
CID 135029399
(3S)-2,3-diphenyl-3,4-dihydropyrazol-5-amine
CID 92982843
5-methyl-3-[(3R)-5-methyl-3-phenyl-3,4-dihydropyrazol-2-yl]-1H-pyrazole
CID 40713714
2-[(3R)-2,3-diphenyl-3,4-dihydropyrazol-5-yl]phenol
CID 135772224
ethane;5-methyl-2-phenyl-3-(trifluoromethyl)-3,4-dihydropyrazole
CID 153380641
sodium 2,3-diphenyl-3,4-dihydropyrazole-5-carboxylate
CID 24844262
4-[5-(4-hydroxyphenyl)-2-phenyl-3,4-dihydropyrazol-3-yl]phenol
CID 166624752
(3S)-5-(2-fluorophenyl)-2,3-diphenyl-3,4-dihydropyrazole
CID 101464946
5-(2,6-dichlorophenyl)-2,3-diphenyl-3,4-dihydropyrazole
CID 170722101

Frequently Asked Questions

What is the IUPAC name of (3R)-5-methyl-2,3-diphenyl-3,4-dihydropyrazole?
The IUPAC name of (3R)-5-methyl-2,3-diphenyl-3,4-dihydropyrazole (CID 684236) is (3R)-5-methyl-2,3-diphenyl-3,4-dihydropyrazole.
What is the SMILES notation for (3R)-5-methyl-2,3-diphenyl-3,4-dihydropyrazole?
The canonical SMILES for (3R)-5-methyl-2,3-diphenyl-3,4-dihydropyrazole is CC1=NN(c2ccccc2)[C@@H](c2ccccc2)C1.
What is the InChIKey of (3R)-5-methyl-2,3-diphenyl-3,4-dihydropyrazole?
The InChIKey is FZTOIOYDPXSQDM-MRXNPFEDSA-N. The full InChI is InChI=1S/C16H16N2/c1-13-12-16(14-8-4-2-5-9-14)18(17-13)15-10-6-3-7-11-15/h2-11,16H,12H2,1H3/t16-/m1/s1.
What are the key properties of (3R)-5-methyl-2,3-diphenyl-3,4-dihydropyrazole?
(3R)-5-methyl-2,3-diphenyl-3,4-dihydropyrazole has a molecular weight of 236.32 g/mol, XLogP of 4.01, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-5-methyl-2,3-diphenyl-3,4-dihydropyrazole is sourced from PubChem (CID 684236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).