3-imidazol-1-yl-4-methyl-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperidine

C16H25N5 — CID 75514660

IUPAC3-imidazol-1-yl-4-methyl-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperidine
SMILESCc1nn(C)c(C)c1CN1CCC(C)C(n2ccnc2)C1
InChIInChI=1S/C16H25N5/c1-12-5-7-20(10-16(12)21-8-6-17-11-21)9-15-13(2)18-19(4)14(15)3/h6,8,11-12,16H,5,7,9-10H2,1-4H3
InChIKeyPVUSLXUUXUVWBM-UHFFFAOYSA-N
MW287.41 g/mol
LogP2.32
Rot. Bonds3

About 3-imidazol-1-yl-4-methyl-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperidine

3-imidazol-1-yl-4-methyl-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperidine (PubChem CID 75514660) has the molecular formula C16H25N5 and a molecular weight of 287.41 g/mol. Its IUPAC name is 3-imidazol-1-yl-4-methyl-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperidine.

Molecular Properties

Compound Name3-imidazol-1-yl-4-methyl-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperidine
PubChem CID75514660
Molecular FormulaC16H25N5
Molecular Weight287.41 g/mol
Exact Mass287.21
IUPAC Name3-imidazol-1-yl-4-methyl-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperidine
SMILESCc1nn(C)c(C)c1CN1CCC(C)C(n2ccnc2)C1
InChIInChI=1S/C16H25N5/c1-12-5-7-20(10-16(12)21-8-6-17-11-21)9-15-13(2)18-19(4)14(15)3/h6,8,11-12,16H,5,7,9-10H2,1-4H3
InChIKeyPVUSLXUUXUVWBM-UHFFFAOYSA-N
XLogP2.32
TPSA38.88 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.41
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 3-imidazol-1-yl-4-methyl-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]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

(3S)-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrrolidin-3-ol
CID 111123110
1-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperidin-4-ol
CID 110912836
2-[(3-imidazol-1-yl-4-methylpiperidin-1-yl)methyl]-3-methylquinazolin-4-one
CID 84593167
3-imidazol-1-yl-4-methyl-1-[(4-pyrazol-1-ylphenyl)methyl]piperidine
CID 75438067
(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)-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperidin-3-ol
CID 129488572
N-ethyl-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrrolidin-3-amine
CID 79238263
methyl 3-[[(3S,4R)-3-imidazol-1-yl-4-methylpiperidin-1-yl]methyl]thiophene-2-carboxylate
CID 98875034
4-methyl-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrrolidin-3-amine
CID 103575106
[1-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperidin-4-yl]methanamine
CID 19623264
4-chloro-1-[(5-chloro-1,3-dimethylpyrazol-4-yl)methyl]-3-methylpiperidine
CID 114682232

Frequently Asked Questions

What is the IUPAC name of 3-imidazol-1-yl-4-methyl-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperidine?
The IUPAC name of 3-imidazol-1-yl-4-methyl-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperidine (CID 75514660) is 3-imidazol-1-yl-4-methyl-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperidine.
What is the SMILES notation for 3-imidazol-1-yl-4-methyl-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperidine?
The canonical SMILES for 3-imidazol-1-yl-4-methyl-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperidine is Cc1nn(C)c(C)c1CN1CCC(C)C(n2ccnc2)C1.
What is the InChIKey of 3-imidazol-1-yl-4-methyl-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperidine?
The InChIKey is PVUSLXUUXUVWBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N5/c1-12-5-7-20(10-16(12)21-8-6-17-11-21)9-15-13(2)18-19(4)14(15)3/h6,8,11-12,16H,5,7,9-10H2,1-4H3.
What are the key properties of 3-imidazol-1-yl-4-methyl-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperidine?
3-imidazol-1-yl-4-methyl-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperidine has a molecular weight of 287.41 g/mol, XLogP of 2.32, 3 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-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperidine is sourced from PubChem (CID 75514660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).