1-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]-2-(2-pyrazol-1-ylethyl)piperidine

C17H27N5O — CID 91838622

IUPAC1-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]-2-(2-pyrazol-1-ylethyl)piperidine
SMILESCOCCn1cncc1CN1CCCCC1CCn1cccn1
InChIInChI=1S/C17H27N5O/c1-23-12-11-21-15-18-13-17(21)14-20-8-3-2-5-16(20)6-10-22-9-4-7-19-22/h4,7,9,13,15-16H,2-3,5-6,8,10-12,14H2,1H3
InChIKeyWHQZVYMNNXRALU-UHFFFAOYSA-N
MW317.44 g/mol
LogP2.17
Rot. Bonds8

About 1-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]-2-(2-pyrazol-1-ylethyl)piperidine

1-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]-2-(2-pyrazol-1-ylethyl)piperidine (PubChem CID 91838622) has the molecular formula C17H27N5O and a molecular weight of 317.44 g/mol. Its IUPAC name is 1-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]-2-(2-pyrazol-1-ylethyl)piperidine.

Molecular Properties

Compound Name1-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]-2-(2-pyrazol-1-ylethyl)piperidine
PubChem CID91838622
Molecular FormulaC17H27N5O
Molecular Weight317.44 g/mol
Exact Mass317.22
IUPAC Name1-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]-2-(2-pyrazol-1-ylethyl)piperidine
SMILESCOCCn1cncc1CN1CCCCC1CCn1cccn1
InChIInChI=1S/C17H27N5O/c1-23-12-11-21-15-18-13-17(21)14-20-8-3-2-5-16(20)6-10-22-9-4-7-19-22/h4,7,9,13,15-16H,2-3,5-6,8,10-12,14H2,1H3
InChIKeyWHQZVYMNNXRALU-UHFFFAOYSA-N
XLogP2.17
TPSA48.11 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.44
LogP ≤ 52.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 1-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]-2-(2-pyrazol-1-ylethyl)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

4-[(1-Ethylimidazol-2-yl)methyl]-2-(pyrazol-1-ylmethyl)morpholine
CID 53557687
2-(Pyrazol-1-ylmethyl)-4-[[1-(2,2,2-trifluoroethyl)imidazol-2-yl]methyl]morpholine
CID 53559180
4-[(1-Methylimidazol-2-yl)methyl]-2-(pyrazol-1-ylmethyl)morpholine
CID 53559205
1-[4-[(1-Ethylimidazol-2-yl)methyl]piperazin-1-yl]-3-pyrazol-1-ylpropan-2-ol
CID 53561114
1-[(1-Methylimidazol-2-yl)methyl]-2-(pyrazol-1-ylmethyl)piperidine
CID 56780345
2-methoxy-5-{1-[1-methyl-3-(1H-pyrazol-1-yl)propyl]-1H-imidazol-2-yl}pyrimidine
CID 56863217
1-[4-(2,5-dimethyl-1H-imidazol-1-yl)piperidino]-3-(1H-pyrazol-1-yl)-1-propanone
CID 124047374
N-{[1-(2-methoxyethyl)-1H-imidazol-5-yl]methyl}-N-methyl-2-(1-methyl-1H-pyrazol-4-yl)ethanamine
CID 91833629
(2S)-2-(pyrazol-1-ylmethyl)-4-[[1-(2,2,2-trifluoroethyl)imidazol-2-yl]methyl]morpholine
CID 95279217
(2R)-2-(pyrazol-1-ylmethyl)-4-[[1-(2,2,2-trifluoroethyl)imidazol-2-yl]methyl]morpholine
CID 95279218
4,4,4-Trifluoro-1-[4-(5-methylimidazol-1-yl)piperidin-1-yl]-3-pyrazol-1-ylbutan-1-one
CID 132322826
1-[(2S,4S)-4-fluoro-1-(pyrimidin-2-ylmethyl)pyrrolidin-2-yl]-N-methyl-N-[(3-methyltriazol-4-yl)methyl]methanamine
CID 154753664

Frequently Asked Questions

What is the IUPAC name of 1-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]-2-(2-pyrazol-1-ylethyl)piperidine?
The IUPAC name of 1-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]-2-(2-pyrazol-1-ylethyl)piperidine (CID 91838622) is 1-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]-2-(2-pyrazol-1-ylethyl)piperidine.
What is the SMILES notation for 1-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]-2-(2-pyrazol-1-ylethyl)piperidine?
The canonical SMILES for 1-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]-2-(2-pyrazol-1-ylethyl)piperidine is COCCn1cncc1CN1CCCCC1CCn1cccn1.
What is the InChIKey of 1-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]-2-(2-pyrazol-1-ylethyl)piperidine?
The InChIKey is WHQZVYMNNXRALU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N5O/c1-23-12-11-21-15-18-13-17(21)14-20-8-3-2-5-16(20)6-10-22-9-4-7-19-22/h4,7,9,13,15-16H,2-3,5-6,8,10-12,14H2,1H3.
What are the key properties of 1-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]-2-(2-pyrazol-1-ylethyl)piperidine?
1-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]-2-(2-pyrazol-1-ylethyl)piperidine has a molecular weight of 317.44 g/mol, XLogP of 2.17, 8 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]-2-(2-pyrazol-1-ylethyl)piperidine is sourced from PubChem (CID 91838622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).