2-(2-ethylimidazol-1-yl)-6-[1-[(4-methoxyphenyl)methyl]piperidin-4-yl]pyridine

C23H28N4O — CID 95838605

IUPAC2-(2-ethylimidazol-1-yl)-6-[1-[(4-methoxyphenyl)methyl]piperidin-4-yl]pyridine
SMILESCCc1nccn1-c1cccc(C2CCN(Cc3ccc(OC)cc3)CC2)n1
InChIInChI=1S/C23H28N4O/c1-3-22-24-13-16-27(22)23-6-4-5-21(25-23)19-11-14-26(15-12-19)17-18-7-9-20(28-2)10-8-18/h4-10,13,16,19H,3,11-12,14-15,17H2,1-2H3
InChIKeyPLKXRZOPQNAYKO-UHFFFAOYSA-N
MW376.50 g/mol
LogP4.22
Rot. Bonds6

About 2-(2-ethylimidazol-1-yl)-6-[1-[(4-methoxyphenyl)methyl]piperidin-4-yl]pyridine

2-(2-ethylimidazol-1-yl)-6-[1-[(4-methoxyphenyl)methyl]piperidin-4-yl]pyridine (PubChem CID 95838605) has the molecular formula C23H28N4O and a molecular weight of 376.50 g/mol. Its IUPAC name is 2-(2-ethylimidazol-1-yl)-6-[1-[(4-methoxyphenyl)methyl]piperidin-4-yl]pyridine.

Molecular Properties

Compound Name2-(2-ethylimidazol-1-yl)-6-[1-[(4-methoxyphenyl)methyl]piperidin-4-yl]pyridine
PubChem CID95838605
Molecular FormulaC23H28N4O
Molecular Weight376.50 g/mol
Exact Mass376.23
IUPAC Name2-(2-ethylimidazol-1-yl)-6-[1-[(4-methoxyphenyl)methyl]piperidin-4-yl]pyridine
SMILESCCc1nccn1-c1cccc(C2CCN(Cc3ccc(OC)cc3)CC2)n1
InChIInChI=1S/C23H28N4O/c1-3-22-24-13-16-27(22)23-6-4-5-21(25-23)19-11-14-26(15-12-19)17-18-7-9-20(28-2)10-8-18/h4-10,13,16,19H,3,11-12,14-15,17H2,1-2H3
InChIKeyPLKXRZOPQNAYKO-UHFFFAOYSA-N
XLogP4.22
TPSA43.18 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.50
LogP ≤ 54.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1-[(3R)-3-[6-(2-ethylimidazol-1-yl)-2-pyridinyl]piperidin-1-yl]-3-(4-methoxyphenyl)propan-1-one
CID 95838850
2-(2-ethylimidazol-1-yl)-6-[(3R)-1-methylpiperidin-3-yl]pyridine
CID 95839018
2-(4-methoxyphenyl)-1-[4-[6-(2-methylimidazol-1-yl)-2-pyridinyl]piperidin-1-yl]ethanone
CID 95838767
2-(1-benzylpyrrolidin-2-yl)-6-(2-ethylimidazol-1-yl)pyridine
CID 110268024
2-(2-ethylimidazol-1-yl)-6-[(2S)-1-methylpyrrolidin-2-yl]pyridine
CID 95839014
2-[(3R)-3-[6-(2-ethylimidazol-1-yl)-2-pyridinyl]piperidin-1-yl]acetamide
CID 95815984
2-(2-ethylimidazol-1-yl)-6-[(3R)-1-[(4-fluorophenyl)methyl]piperidin-3-yl]pyrazine
CID 95815716
[(3R)-3-[6-(2-ethylimidazol-1-yl)-2-pyridinyl]piperidin-1-yl]-phenylmethanone
CID 95838783
2-(2-ethylimidazol-1-yl)-6-[(2R)-1-(thiophen-3-ylmethyl)pyrrolidin-2-yl]pyridine
CID 95815941
4-ethyl-1-[(4-methoxyphenyl)methyl]piperidine
CID 23381464
2-[(2R)-2-[6-(2-ethylimidazol-1-yl)-2-pyridinyl]pyrrolidin-1-yl]ethanol
CID 95815943
1-[(2S)-2-[6-(2-ethylimidazol-1-yl)-2-pyridinyl]pyrrolidin-1-yl]ethanone
CID 95815928

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethylimidazol-1-yl)-6-[1-[(4-methoxyphenyl)methyl]piperidin-4-yl]pyridine?
The IUPAC name of 2-(2-ethylimidazol-1-yl)-6-[1-[(4-methoxyphenyl)methyl]piperidin-4-yl]pyridine (CID 95838605) is 2-(2-ethylimidazol-1-yl)-6-[1-[(4-methoxyphenyl)methyl]piperidin-4-yl]pyridine.
What is the SMILES notation for 2-(2-ethylimidazol-1-yl)-6-[1-[(4-methoxyphenyl)methyl]piperidin-4-yl]pyridine?
The canonical SMILES for 2-(2-ethylimidazol-1-yl)-6-[1-[(4-methoxyphenyl)methyl]piperidin-4-yl]pyridine is CCc1nccn1-c1cccc(C2CCN(Cc3ccc(OC)cc3)CC2)n1.
What is the InChIKey of 2-(2-ethylimidazol-1-yl)-6-[1-[(4-methoxyphenyl)methyl]piperidin-4-yl]pyridine?
The InChIKey is PLKXRZOPQNAYKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28N4O/c1-3-22-24-13-16-27(22)23-6-4-5-21(25-23)19-11-14-26(15-12-19)17-18-7-9-20(28-2)10-8-18/h4-10,13,16,19H,3,11-12,14-15,17H2,1-2H3.
What are the key properties of 2-(2-ethylimidazol-1-yl)-6-[1-[(4-methoxyphenyl)methyl]piperidin-4-yl]pyridine?
2-(2-ethylimidazol-1-yl)-6-[1-[(4-methoxyphenyl)methyl]piperidin-4-yl]pyridine has a molecular weight of 376.50 g/mol, XLogP of 4.22, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethylimidazol-1-yl)-6-[1-[(4-methoxyphenyl)methyl]piperidin-4-yl]pyridine is sourced from PubChem (CID 95838605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).