3-imidazol-1-yl-4-methyl-1-[(4-pyrazol-1-ylphenyl)methyl]piperidine

C19H23N5 — CID 75438067

IUPAC3-imidazol-1-yl-4-methyl-1-[(4-pyrazol-1-ylphenyl)methyl]piperidine
SMILESCC1CCN(Cc2ccc(-n3cccn3)cc2)CC1n1ccnc1
InChIInChI=1S/C19H23N5/c1-16-7-11-22(14-19(16)23-12-9-20-15-23)13-17-3-5-18(6-4-17)24-10-2-8-21-24/h2-6,8-10,12,15-16,19H,7,11,13-14H2,1H3
InChIKeyZYTJSWGYRHMFTF-UHFFFAOYSA-N
MW321.43 g/mol
LogP3.15
Rot. Bonds4

About 3-imidazol-1-yl-4-methyl-1-[(4-pyrazol-1-ylphenyl)methyl]piperidine

3-imidazol-1-yl-4-methyl-1-[(4-pyrazol-1-ylphenyl)methyl]piperidine (PubChem CID 75438067) has the molecular formula C19H23N5 and a molecular weight of 321.43 g/mol. Its IUPAC name is 3-imidazol-1-yl-4-methyl-1-[(4-pyrazol-1-ylphenyl)methyl]piperidine.

Molecular Properties

Compound Name3-imidazol-1-yl-4-methyl-1-[(4-pyrazol-1-ylphenyl)methyl]piperidine
PubChem CID75438067
Molecular FormulaC19H23N5
Molecular Weight321.43 g/mol
Exact Mass321.20
IUPAC Name3-imidazol-1-yl-4-methyl-1-[(4-pyrazol-1-ylphenyl)methyl]piperidine
SMILESCC1CCN(Cc2ccc(-n3cccn3)cc2)CC1n1ccnc1
InChIInChI=1S/C19H23N5/c1-16-7-11-22(14-19(16)23-12-9-20-15-23)13-17-3-5-18(6-4-17)24-10-2-8-21-24/h2-6,8-10,12,15-16,19H,7,11,13-14H2,1H3
InChIKeyZYTJSWGYRHMFTF-UHFFFAOYSA-N
XLogP3.15
TPSA38.88 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.43
LogP ≤ 53.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

3-methyl-1-[(4-pyrazol-1-ylphenyl)methyl]piperidin-4-ol
CID 114681410
(3S,4R)-1-[(1-benzylpyrazol-4-yl)methyl]-3-imidazol-1-yl-4-methylpiperidine
CID 124776982
(3R)-1-[(4-pyrazol-1-ylphenyl)methyl]pyrrolidin-3-ol
CID 63365329
3-methyl-1-[(4-pyrazol-1-ylphenyl)methyl]piperidin-4-amine
CID 79868378
(3R,4R)-3-imidazol-1-yl-4-methyl-1-[(2-phenyl-1,2,4-triazol-3-yl)methyl]piperidine
CID 124874625
1-[(4-pyrazol-1-ylphenyl)methyl]pyrrolidin-3-amine;hydrochloride
CID 119917477
4-methyl-1-[(4-pyrazol-1-ylphenyl)methyl]pyrrolidin-3-amine
CID 103576557
3-imidazol-1-yl-4-methyl-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperidine
CID 75514660
(3S,4R)-3-imidazol-1-yl-4-methyl-1-(2-phenylsulfanylethyl)piperidine
CID 124784269
(3R,4S)-3-imidazol-1-yl-4-methyl-1-(2-phenylsulfanylethyl)piperidine
CID 97092565
(3R,4R)-4-(4-methylpiperazin-1-yl)-1-[(4-pyrazol-1-ylphenyl)methyl]pyrrolidin-3-ol
CID 133127360
2-[(3-imidazol-1-yl-4-methylpiperidin-1-yl)methyl]-3-methylquinazolin-4-one
CID 84593167

Frequently Asked Questions

What is the IUPAC name of 3-imidazol-1-yl-4-methyl-1-[(4-pyrazol-1-ylphenyl)methyl]piperidine?
The IUPAC name of 3-imidazol-1-yl-4-methyl-1-[(4-pyrazol-1-ylphenyl)methyl]piperidine (CID 75438067) is 3-imidazol-1-yl-4-methyl-1-[(4-pyrazol-1-ylphenyl)methyl]piperidine.
What is the SMILES notation for 3-imidazol-1-yl-4-methyl-1-[(4-pyrazol-1-ylphenyl)methyl]piperidine?
The canonical SMILES for 3-imidazol-1-yl-4-methyl-1-[(4-pyrazol-1-ylphenyl)methyl]piperidine is CC1CCN(Cc2ccc(-n3cccn3)cc2)CC1n1ccnc1.
What is the InChIKey of 3-imidazol-1-yl-4-methyl-1-[(4-pyrazol-1-ylphenyl)methyl]piperidine?
The InChIKey is ZYTJSWGYRHMFTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N5/c1-16-7-11-22(14-19(16)23-12-9-20-15-23)13-17-3-5-18(6-4-17)24-10-2-8-21-24/h2-6,8-10,12,15-16,19H,7,11,13-14H2,1H3.
What are the key properties of 3-imidazol-1-yl-4-methyl-1-[(4-pyrazol-1-ylphenyl)methyl]piperidine?
3-imidazol-1-yl-4-methyl-1-[(4-pyrazol-1-ylphenyl)methyl]piperidine has a molecular weight of 321.43 g/mol, XLogP of 3.15, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-imidazol-1-yl-4-methyl-1-[(4-pyrazol-1-ylphenyl)methyl]piperidine is sourced from PubChem (CID 75438067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).