2-[2-[1-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]piperidin-2-yl]ethyl]pyridine

C19H28N4O — CID 91832850

IUPAC2-[2-[1-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]piperidin-2-yl]ethyl]pyridine
SMILESCOCCn1cncc1CN1CCCCC1CCc1ccccn1
InChIInChI=1S/C19H28N4O/c1-24-13-12-23-16-20-14-19(23)15-22-11-5-3-7-18(22)9-8-17-6-2-4-10-21-17/h2,4,6,10,14,16,18H,3,5,7-9,11-13,15H2,1H3
InChIKeyMZTMZBCJGFVJDZ-UHFFFAOYSA-N
MW328.46 g/mol
LogP2.91
Rot. Bonds8

About 2-[2-[1-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]piperidin-2-yl]ethyl]pyridine

2-[2-[1-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]piperidin-2-yl]ethyl]pyridine (PubChem CID 91832850) has the molecular formula C19H28N4O and a molecular weight of 328.46 g/mol. Its IUPAC name is 2-[2-[1-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]piperidin-2-yl]ethyl]pyridine.

Molecular Properties

Compound Name2-[2-[1-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]piperidin-2-yl]ethyl]pyridine
PubChem CID91832850
Molecular FormulaC19H28N4O
Molecular Weight328.46 g/mol
Exact Mass328.23
IUPAC Name2-[2-[1-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]piperidin-2-yl]ethyl]pyridine
SMILESCOCCn1cncc1CN1CCCCC1CCc1ccccn1
InChIInChI=1S/C19H28N4O/c1-24-13-12-23-16-20-14-19(23)15-22-11-5-3-7-18(22)9-8-17-6-2-4-10-21-17/h2,4,6,10,14,16,18H,3,5,7-9,11-13,15H2,1H3
InChIKeyMZTMZBCJGFVJDZ-UHFFFAOYSA-N
XLogP2.91
TPSA43.18 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.46
LogP ≤ 52.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-[1-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]piperidin-2-yl]pyridine
CID 91838335
3-(2-methoxyethyl)-5-[[(2S)-2-(2-pyridin-2-ylethyl)piperidin-1-yl]methyl]-1,2,4-oxadiazole
CID 124758455
2-[2-[(2R)-1-(1H-pyrazol-5-ylmethyl)piperidin-2-yl]ethyl]pyridine
CID 29214676
2-[2-[(2S)-1-[2-(1H-pyrazol-4-yl)ethyl]piperidin-2-yl]ethyl]pyridine
CID 124758900
2-[2-[1-[(5-methyl-1H-imidazol-4-yl)methyl]piperidin-2-yl]ethyl]pyridine
CID 77096975
2-methoxy-5-[[(2R)-2-(2-pyridin-2-ylethyl)piperidin-1-yl]methyl]benzoic acid
CID 99927710
N,N-dimethyl-6-[2-[(2R)-1-(pyridin-2-ylmethyl)piperidin-2-yl]ethyl]pyridin-2-amine
CID 124948158
N,N-dimethyl-3-[(2R)-2-(2-pyridin-2-ylethyl)piperidin-1-yl]propane-1-sulfonamide
CID 124846378
2-[2-[1-[[5-(1H-pyrazol-5-yl)thiophen-2-yl]methyl]piperidin-2-yl]ethyl]pyridine
CID 131893488
5-[[3-(2-chlorophenyl)pyrrolidin-1-yl]methyl]-1-(2-methoxyethyl)imidazole
CID 91840373
5-[[(3R)-3-(2-chlorophenyl)pyrrolidin-1-yl]methyl]-1-(2-methoxyethyl)imidazole
CID 124753499
N-pyridin-3-yl-3-[(2R)-2-(2-pyridin-2-ylethyl)piperidin-1-yl]propanamide
CID 124756224

Frequently Asked Questions

What is the IUPAC name of 2-[2-[1-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]piperidin-2-yl]ethyl]pyridine?
The IUPAC name of 2-[2-[1-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]piperidin-2-yl]ethyl]pyridine (CID 91832850) is 2-[2-[1-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]piperidin-2-yl]ethyl]pyridine.
What is the SMILES notation for 2-[2-[1-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]piperidin-2-yl]ethyl]pyridine?
The canonical SMILES for 2-[2-[1-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]piperidin-2-yl]ethyl]pyridine is COCCn1cncc1CN1CCCCC1CCc1ccccn1.
What is the InChIKey of 2-[2-[1-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]piperidin-2-yl]ethyl]pyridine?
The InChIKey is MZTMZBCJGFVJDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N4O/c1-24-13-12-23-16-20-14-19(23)15-22-11-5-3-7-18(22)9-8-17-6-2-4-10-21-17/h2,4,6,10,14,16,18H,3,5,7-9,11-13,15H2,1H3.
What are the key properties of 2-[2-[1-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]piperidin-2-yl]ethyl]pyridine?
2-[2-[1-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]piperidin-2-yl]ethyl]pyridine has a molecular weight of 328.46 g/mol, XLogP of 2.91, 8 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[1-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]piperidin-2-yl]ethyl]pyridine is sourced from PubChem (CID 91832850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).