4-(4-ethyl-1,5-diphenylpyrazol-3-yl)piperidine

C22H25N3 — CID 177339507

IUPAC4-(4-ethyl-1,5-diphenylpyrazol-3-yl)piperidine
SMILESCCc1c(C2CCNCC2)nn(-c2ccccc2)c1-c1ccccc1
InChIInChI=1S/C22H25N3/c1-2-20-21(17-13-15-23-16-14-17)24-25(19-11-7-4-8-12-19)22(20)18-9-5-3-6-10-18/h3-12,17,23H,2,13-16H2,1H3
InChIKeySRKYAZOFVGSKAD-UHFFFAOYSA-N
MW331.46 g/mol
LogP4.57
Rot. Bonds4

About 4-(4-ethyl-1,5-diphenylpyrazol-3-yl)piperidine

4-(4-ethyl-1,5-diphenylpyrazol-3-yl)piperidine (PubChem CID 177339507) has the molecular formula C22H25N3 and a molecular weight of 331.46 g/mol. Its IUPAC name is 4-(4-ethyl-1,5-diphenylpyrazol-3-yl)piperidine.

Molecular Properties

Compound Name4-(4-ethyl-1,5-diphenylpyrazol-3-yl)piperidine
PubChem CID177339507
Molecular FormulaC22H25N3
Molecular Weight331.46 g/mol
Exact Mass331.20
IUPAC Name4-(4-ethyl-1,5-diphenylpyrazol-3-yl)piperidine
SMILESCCc1c(C2CCNCC2)nn(-c2ccccc2)c1-c1ccccc1
InChIInChI=1S/C22H25N3/c1-2-20-21(17-13-15-23-16-14-17)24-25(19-11-7-4-8-12-19)22(20)18-9-5-3-6-10-18/h3-12,17,23H,2,13-16H2,1H3
InChIKeySRKYAZOFVGSKAD-UHFFFAOYSA-N
XLogP4.57
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.46
LogP ≤ 54.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(3-ethyl-1-phenylpyrazol-4-yl)piperidine
CID 174757890
4-[1,5-bis(4-methoxyphenyl)-4-methylpyrazol-3-yl]piperidine
CID 145464422
2-(4-ethyl-1,5-diphenylpyrazol-3-yl)acetic acid
CID 10614604
4-ethyl-3,5-bis(4-methoxyphenyl)-1-phenylpyrazole
CID 19586817
4-ethyl-1-(4-methoxyphenyl)-3,5-diphenylpyrazole
CID 10808049
3-ethyl-1-phenyl-6-(4-pyrrolidin-3-ylphenyl)indazole
CID 58483583
4-(3-phenyltriazol-4-yl)piperidine
CID 84692024
3-ethyl-1-phenyl-6-(4-pyrrolidin-3-ylphenyl)indazole;hydrochloride
CID 162332780
5-methyl-2-phenyl-4-piperidin-4-yl-1,3-oxazole
CID 115044754
4-ethyl-5-(2-methylcyclopentyl)-2-phenylpyrazol-3-amine
CID 107179201
methanamine;4-phenylpiperidine
CID 143444696
4-bromo-5-ethyl-6-fluoro-2,3,7-triphenylindazole
CID 175284626

Frequently Asked Questions

What is the IUPAC name of 4-(4-ethyl-1,5-diphenylpyrazol-3-yl)piperidine?
The IUPAC name of 4-(4-ethyl-1,5-diphenylpyrazol-3-yl)piperidine (CID 177339507) is 4-(4-ethyl-1,5-diphenylpyrazol-3-yl)piperidine.
What is the SMILES notation for 4-(4-ethyl-1,5-diphenylpyrazol-3-yl)piperidine?
The canonical SMILES for 4-(4-ethyl-1,5-diphenylpyrazol-3-yl)piperidine is CCc1c(C2CCNCC2)nn(-c2ccccc2)c1-c1ccccc1.
What is the InChIKey of 4-(4-ethyl-1,5-diphenylpyrazol-3-yl)piperidine?
The InChIKey is SRKYAZOFVGSKAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25N3/c1-2-20-21(17-13-15-23-16-14-17)24-25(19-11-7-4-8-12-19)22(20)18-9-5-3-6-10-18/h3-12,17,23H,2,13-16H2,1H3.
What are the key properties of 4-(4-ethyl-1,5-diphenylpyrazol-3-yl)piperidine?
4-(4-ethyl-1,5-diphenylpyrazol-3-yl)piperidine has a molecular weight of 331.46 g/mol, XLogP of 4.57, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-ethyl-1,5-diphenylpyrazol-3-yl)piperidine is sourced from PubChem (CID 177339507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).