(2R,4R)-2-ethyl-4-[2-(2-phenylpyrazol-3-yl)imidazol-1-yl]piperidine

C19H23N5 — CID 154567649

IUPAC(2R,4R)-2-ethyl-4-[2-(2-phenylpyrazol-3-yl)imidazol-1-yl]piperidine
SMILESCC[C@@H]1C[C@H](n2ccnc2-c2ccnn2-c2ccccc2)CCN1
InChIInChI=1S/C19H23N5/c1-2-15-14-17(8-10-20-15)23-13-12-21-19(23)18-9-11-22-24(18)16-6-4-3-5-7-16/h3-7,9,11-13,15,17,20H,2,8,10,14H2,1H3/t15-,17-/m1/s1
InChIKeyXMYXTVPVGDVURO-NVXWUHKLSA-N
MW321.43 g/mol
LogP3.44
Rot. Bonds4

About (2R,4R)-2-ethyl-4-[2-(2-phenylpyrazol-3-yl)imidazol-1-yl]piperidine

(2R,4R)-2-ethyl-4-[2-(2-phenylpyrazol-3-yl)imidazol-1-yl]piperidine (PubChem CID 154567649) has the molecular formula C19H23N5 and a molecular weight of 321.43 g/mol. Its IUPAC name is (2R,4R)-2-ethyl-4-[2-(2-phenylpyrazol-3-yl)imidazol-1-yl]piperidine.

Molecular Properties

Compound Name(2R,4R)-2-ethyl-4-[2-(2-phenylpyrazol-3-yl)imidazol-1-yl]piperidine
PubChem CID154567649
Molecular FormulaC19H23N5
Molecular Weight321.43 g/mol
Exact Mass321.20
IUPAC Name(2R,4R)-2-ethyl-4-[2-(2-phenylpyrazol-3-yl)imidazol-1-yl]piperidine
SMILESCC[C@@H]1C[C@H](n2ccnc2-c2ccnn2-c2ccccc2)CCN1
InChIInChI=1S/C19H23N5/c1-2-15-14-17(8-10-20-15)23-13-12-21-19(23)18-9-11-22-24(18)16-6-4-3-5-7-16/h3-7,9,11-13,15,17,20H,2,8,10,14H2,1H3/t15-,17-/m1/s1
InChIKeyXMYXTVPVGDVURO-NVXWUHKLSA-N
XLogP3.44
TPSA47.67 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.43
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze (2R,4R)-2-ethyl-4-[2-(2-phenylpyrazol-3-yl)imidazol-1-yl]piperidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2R,4R)-4-[2-(2,6-dichlorophenyl)imidazol-1-yl]-2-ethylpiperidine;dihydrochloride
CID 154923336
1-ethyl-3-[2-(2-phenylpyrazol-3-yl)imidazol-1-yl]piperidine
CID 146043336
(2R,4R)-4-[2-(2,4-difluorophenyl)imidazol-1-yl]-2-ethylpiperidine
CID 146046104
(2S,4R)-2-ethyl-4-[2-[3-(trifluoromethyl)phenyl]imidazol-1-yl]piperidine
CID 154566736
(2R,4R)-2-ethyl-4-[2-(4-methoxy-2-methylphenyl)imidazol-1-yl]piperidine
CID 154817045
acetic acid;6-[1-[(2S,4S)-2-ethylpiperidin-4-yl]imidazol-2-yl]quinoline
CID 154921481
(2S,4R)-2-ethyl-4-[2-(6-methoxy-2H-chromen-3-yl)imidazol-1-yl]piperidine;dihydrochloride
CID 154922547
N,N-dimethyl-1-[(3R,4S)-4-[2-(2-phenylpyrazol-3-yl)imidazol-1-yl]oxolan-3-yl]methanesulfonamide
CID 166622045
acetic acid;N-ethyl-N-[[5-[1-[(2S,4R)-2-ethylpiperidin-4-yl]imidazol-2-yl]-2-methoxyphenyl]methyl]ethanamine
CID 163333561
4-[2-[1-[(2R,4R)-2-ethylpiperidin-4-yl]imidazol-2-yl]-2-methylpropyl]morpholine;dihydrochloride
CID 154919932
(2S,4R)-4-[2-(2,6-difluorophenyl)imidazol-1-yl]-2-methylpiperidine;hydrochloride
CID 154920497
1-methyl-4-[2-[2-(2-phenylpyrazol-3-yl)imidazol-1-yl]ethyl]pyrazole
CID 146044354

Frequently Asked Questions

What is the IUPAC name of (2R,4R)-2-ethyl-4-[2-(2-phenylpyrazol-3-yl)imidazol-1-yl]piperidine?
The IUPAC name of (2R,4R)-2-ethyl-4-[2-(2-phenylpyrazol-3-yl)imidazol-1-yl]piperidine (CID 154567649) is (2R,4R)-2-ethyl-4-[2-(2-phenylpyrazol-3-yl)imidazol-1-yl]piperidine.
What is the SMILES notation for (2R,4R)-2-ethyl-4-[2-(2-phenylpyrazol-3-yl)imidazol-1-yl]piperidine?
The canonical SMILES for (2R,4R)-2-ethyl-4-[2-(2-phenylpyrazol-3-yl)imidazol-1-yl]piperidine is CC[C@@H]1C[C@H](n2ccnc2-c2ccnn2-c2ccccc2)CCN1.
What is the InChIKey of (2R,4R)-2-ethyl-4-[2-(2-phenylpyrazol-3-yl)imidazol-1-yl]piperidine?
The InChIKey is XMYXTVPVGDVURO-NVXWUHKLSA-N. The full InChI is InChI=1S/C19H23N5/c1-2-15-14-17(8-10-20-15)23-13-12-21-19(23)18-9-11-22-24(18)16-6-4-3-5-7-16/h3-7,9,11-13,15,17,20H,2,8,10,14H2,1H3/t15-,17-/m1/s1.
What are the key properties of (2R,4R)-2-ethyl-4-[2-(2-phenylpyrazol-3-yl)imidazol-1-yl]piperidine?
(2R,4R)-2-ethyl-4-[2-(2-phenylpyrazol-3-yl)imidazol-1-yl]piperidine has a molecular weight of 321.43 g/mol, XLogP of 3.44, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,4R)-2-ethyl-4-[2-(2-phenylpyrazol-3-yl)imidazol-1-yl]piperidine is sourced from PubChem (CID 154567649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).