4-(4-methyl-3-phenyl-1H-pyrazol-5-yl)-1-(2-phenylethyl)-3,6-dihydro-2H-pyridine

C23H25N3 — CID 10617366

IUPAC4-(4-methyl-3-phenyl-1H-pyrazol-5-yl)-1-(2-phenylethyl)-3,6-dihydro-2H-pyridine
SMILESCc1c(-c2ccccc2)n[nH]c1C1=CCN(CCc2ccccc2)CC1
InChIInChI=1S/C23H25N3/c1-18-22(20-10-6-3-7-11-20)24-25-23(18)21-13-16-26(17-14-21)15-12-19-8-4-2-5-9-19/h2-11,13H,12,14-17H2,1H3,(H,24,25)
InChIKeyYYWRRBMZAGSBNZ-UHFFFAOYSA-N
MW343.47 g/mol
LogP4.72
Rot. Bonds5

About 4-(4-methyl-3-phenyl-1H-pyrazol-5-yl)-1-(2-phenylethyl)-3,6-dihydro-2H-pyridine

4-(4-methyl-3-phenyl-1H-pyrazol-5-yl)-1-(2-phenylethyl)-3,6-dihydro-2H-pyridine (PubChem CID 10617366) has the molecular formula C23H25N3 and a molecular weight of 343.47 g/mol. Its IUPAC name is 4-(4-methyl-3-phenyl-1H-pyrazol-5-yl)-1-(2-phenylethyl)-3,6-dihydro-2H-pyridine.

Molecular Properties

Compound Name4-(4-methyl-3-phenyl-1H-pyrazol-5-yl)-1-(2-phenylethyl)-3,6-dihydro-2H-pyridine
PubChem CID10617366
Molecular FormulaC23H25N3
Molecular Weight343.47 g/mol
Exact Mass343.20
IUPAC Name4-(4-methyl-3-phenyl-1H-pyrazol-5-yl)-1-(2-phenylethyl)-3,6-dihydro-2H-pyridine
SMILESCc1c(-c2ccccc2)n[nH]c1C1=CCN(CCc2ccccc2)CC1
InChIInChI=1S/C23H25N3/c1-18-22(20-10-6-3-7-11-20)24-25-23(18)21-13-16-26(17-14-21)15-12-19-8-4-2-5-9-19/h2-11,13H,12,14-17H2,1H3,(H,24,25)
InChIKeyYYWRRBMZAGSBNZ-UHFFFAOYSA-N
XLogP4.72
TPSA31.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.47
LogP ≤ 54.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(4-methyl-3-phenyl-1H-pyrazol-5-yl)-1-(2-phenylethyl)-3,6-dihydro-2H-pyridine?
The IUPAC name of 4-(4-methyl-3-phenyl-1H-pyrazol-5-yl)-1-(2-phenylethyl)-3,6-dihydro-2H-pyridine (CID 10617366) is 4-(4-methyl-3-phenyl-1H-pyrazol-5-yl)-1-(2-phenylethyl)-3,6-dihydro-2H-pyridine.
What is the SMILES notation for 4-(4-methyl-3-phenyl-1H-pyrazol-5-yl)-1-(2-phenylethyl)-3,6-dihydro-2H-pyridine?
The canonical SMILES for 4-(4-methyl-3-phenyl-1H-pyrazol-5-yl)-1-(2-phenylethyl)-3,6-dihydro-2H-pyridine is Cc1c(-c2ccccc2)n[nH]c1C1=CCN(CCc2ccccc2)CC1.
What is the InChIKey of 4-(4-methyl-3-phenyl-1H-pyrazol-5-yl)-1-(2-phenylethyl)-3,6-dihydro-2H-pyridine?
The InChIKey is YYWRRBMZAGSBNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N3/c1-18-22(20-10-6-3-7-11-20)24-25-23(18)21-13-16-26(17-14-21)15-12-19-8-4-2-5-9-19/h2-11,13H,12,14-17H2,1H3,(H,24,25).
What are the key properties of 4-(4-methyl-3-phenyl-1H-pyrazol-5-yl)-1-(2-phenylethyl)-3,6-dihydro-2H-pyridine?
4-(4-methyl-3-phenyl-1H-pyrazol-5-yl)-1-(2-phenylethyl)-3,6-dihydro-2H-pyridine has a molecular weight of 343.47 g/mol, XLogP of 4.72, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methyl-3-phenyl-1H-pyrazol-5-yl)-1-(2-phenylethyl)-3,6-dihydro-2H-pyridine is sourced from PubChem (CID 10617366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).