5-(imidazol-1-ylmethyl)-2-[3-(2-methylphenyl)piperidin-1-yl]pyridine

C21H24N4 — CID 70755880

IUPAC5-(imidazol-1-ylmethyl)-2-[3-(2-methylphenyl)piperidin-1-yl]pyridine
SMILESCc1ccccc1C1CCCN(c2ccc(Cn3ccnc3)cn2)C1
InChIInChI=1S/C21H24N4/c1-17-5-2-3-7-20(17)19-6-4-11-25(15-19)21-9-8-18(13-23-21)14-24-12-10-22-16-24/h2-3,5,7-10,12-13,16,19H,4,6,11,14-15H2,1H3
InChIKeyWEHXPWSPNWQOCZ-UHFFFAOYSA-N
MW332.45 g/mol
LogP4.02
Rot. Bonds4

About 5-(imidazol-1-ylmethyl)-2-[3-(2-methylphenyl)piperidin-1-yl]pyridine

5-(imidazol-1-ylmethyl)-2-[3-(2-methylphenyl)piperidin-1-yl]pyridine (PubChem CID 70755880) has the molecular formula C21H24N4 and a molecular weight of 332.45 g/mol. Its IUPAC name is 5-(imidazol-1-ylmethyl)-2-[3-(2-methylphenyl)piperidin-1-yl]pyridine.

Molecular Properties

Compound Name5-(imidazol-1-ylmethyl)-2-[3-(2-methylphenyl)piperidin-1-yl]pyridine
PubChem CID70755880
Molecular FormulaC21H24N4
Molecular Weight332.45 g/mol
Exact Mass332.20
IUPAC Name5-(imidazol-1-ylmethyl)-2-[3-(2-methylphenyl)piperidin-1-yl]pyridine
SMILESCc1ccccc1C1CCCN(c2ccc(Cn3ccnc3)cn2)C1
InChIInChI=1S/C21H24N4/c1-17-5-2-3-7-20(17)19-6-4-11-25(15-19)21-9-8-18(13-23-21)14-24-12-10-22-16-24/h2-3,5,7-10,12-13,16,19H,4,6,11,14-15H2,1H3
InChIKeyWEHXPWSPNWQOCZ-UHFFFAOYSA-N
XLogP4.02
TPSA33.95 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.45
LogP ≤ 54.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 5-(imidazol-1-ylmethyl)-2-[3-(2-methylphenyl)piperidin-1-yl]pyridine 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

[1-[5-(imidazol-1-ylmethyl)-2-pyridinyl]piperidin-3-yl]-phenylmethanone
CID 70723601
2-[3-[(4-fluorophenoxy)methyl]piperidin-1-yl]-5-(imidazol-1-ylmethyl)pyridine
CID 70717549
1-(4-fluorophenyl)-4-[5-(imidazol-1-ylmethyl)-2-pyridinyl]-1,4-diazepane
CID 70729491
(3aR,4R,7aS)-4-ethyl-2-[5-(imidazol-1-ylmethyl)-2-pyridinyl]-3,3a,5,6,7,7a-hexahydro-1H-isoindol-4-ol
CID 135117256
5-methyl-2-[3-[1-(pyridin-3-ylmethyl)imidazol-2-yl]piperidin-1-yl]pyridine
CID 70776652
[(3R)-1-[5-(imidazol-1-ylmethyl)-2-pyridinyl]-3-(3-methylbut-2-enyl)piperidin-3-yl]methanol
CID 97150090
N-[3-(imidazol-1-ylmethyl)phenyl]-2-(2-methylphenyl)pyrrolidine-1-carboxamide
CID 47050883
(3S)-3-(2-methylphenyl)-1-[(1-methylpyrazol-4-yl)methyl]piperidine
CID 95872001
1-[(3-cyclohexyl-5-methylphenyl)methyl]imidazole
CID 86299944
1-[[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]methyl]-3-[4-(imidazol-1-ylmethyl)phenyl]urea
CID 86933242
N-ethyl-N'-[[4-(imidazol-1-ylmethyl)phenyl]methyl]-2-(2-methylphenyl)morpholine-4-carboximidamide
CID 109481185
3-[(3S)-3-[5-(imidazol-1-ylmethyl)-4-methyl-1,2,4-triazol-3-yl]piperidin-1-yl]-2,5-dimethylpyrazine
CID 97204162

Frequently Asked Questions

What is the IUPAC name of 5-(imidazol-1-ylmethyl)-2-[3-(2-methylphenyl)piperidin-1-yl]pyridine?
The IUPAC name of 5-(imidazol-1-ylmethyl)-2-[3-(2-methylphenyl)piperidin-1-yl]pyridine (CID 70755880) is 5-(imidazol-1-ylmethyl)-2-[3-(2-methylphenyl)piperidin-1-yl]pyridine.
What is the SMILES notation for 5-(imidazol-1-ylmethyl)-2-[3-(2-methylphenyl)piperidin-1-yl]pyridine?
The canonical SMILES for 5-(imidazol-1-ylmethyl)-2-[3-(2-methylphenyl)piperidin-1-yl]pyridine is Cc1ccccc1C1CCCN(c2ccc(Cn3ccnc3)cn2)C1.
What is the InChIKey of 5-(imidazol-1-ylmethyl)-2-[3-(2-methylphenyl)piperidin-1-yl]pyridine?
The InChIKey is WEHXPWSPNWQOCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N4/c1-17-5-2-3-7-20(17)19-6-4-11-25(15-19)21-9-8-18(13-23-21)14-24-12-10-22-16-24/h2-3,5,7-10,12-13,16,19H,4,6,11,14-15H2,1H3.
What are the key properties of 5-(imidazol-1-ylmethyl)-2-[3-(2-methylphenyl)piperidin-1-yl]pyridine?
5-(imidazol-1-ylmethyl)-2-[3-(2-methylphenyl)piperidin-1-yl]pyridine has a molecular weight of 332.45 g/mol, XLogP of 4.02, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(imidazol-1-ylmethyl)-2-[3-(2-methylphenyl)piperidin-1-yl]pyridine is sourced from PubChem (CID 70755880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).