2-methyl-6-[[1-[(1-methylimidazol-2-yl)methyl]piperidin-3-yl]methyl]pyridine

C17H24N4 — CID 127246408

IUPAC2-methyl-6-[[1-[(1-methylimidazol-2-yl)methyl]piperidin-3-yl]methyl]pyridine
SMILESCc1cccc(CC2CCCN(Cc3nccn3C)C2)n1
InChIInChI=1S/C17H24N4/c1-14-5-3-7-16(19-14)11-15-6-4-9-21(12-15)13-17-18-8-10-20(17)2/h3,5,7-8,10,15H,4,6,9,11-13H2,1-2H3
InChIKeyZNEISVQNXHFGAQ-UHFFFAOYSA-N
MW284.41 g/mol
LogP2.58
Rot. Bonds4

About 2-methyl-6-[[1-[(1-methylimidazol-2-yl)methyl]piperidin-3-yl]methyl]pyridine

2-methyl-6-[[1-[(1-methylimidazol-2-yl)methyl]piperidin-3-yl]methyl]pyridine (PubChem CID 127246408) has the molecular formula C17H24N4 and a molecular weight of 284.41 g/mol. Its IUPAC name is 2-methyl-6-[[1-[(1-methylimidazol-2-yl)methyl]piperidin-3-yl]methyl]pyridine.

Molecular Properties

Compound Name2-methyl-6-[[1-[(1-methylimidazol-2-yl)methyl]piperidin-3-yl]methyl]pyridine
PubChem CID127246408
Molecular FormulaC17H24N4
Molecular Weight284.41 g/mol
Exact Mass284.20
IUPAC Name2-methyl-6-[[1-[(1-methylimidazol-2-yl)methyl]piperidin-3-yl]methyl]pyridine
SMILESCc1cccc(CC2CCCN(Cc3nccn3C)C2)n1
InChIInChI=1S/C17H24N4/c1-14-5-3-7-16(19-14)11-15-6-4-9-21(12-15)13-17-18-8-10-20(17)2/h3,5,7-8,10,15H,4,6,9,11-13H2,1-2H3
InChIKeyZNEISVQNXHFGAQ-UHFFFAOYSA-N
XLogP2.58
TPSA33.95 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.41
LogP ≤ 52.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-6-[[(3R)-1-[(1-methylpyrazol-3-yl)methyl]piperidin-3-yl]methyl]pyridine
CID 124976617
2-[[1-(1H-imidazol-2-ylmethyl)piperidin-3-yl]methyl]-6-methylpyridine
CID 110095075
2-methyl-6-[[(3S)-1-(pyridin-3-ylmethyl)piperidin-3-yl]methyl]pyridine
CID 124952443
2-methyl-6-[[3-(1H-pyrazol-5-ylmethyl)piperidin-1-yl]methyl]pyridine
CID 110106337
3-[(1-methylimidazol-2-yl)methyl]-1-[(1-methylpyrrol-3-yl)methyl]piperidine
CID 154752270
2-methyl-4-[(3S)-1-[(1-methylimidazol-2-yl)methyl]piperidin-3-yl]pyrimidine
CID 95816201
N-methyl-6-[1-[(1-methylimidazol-2-yl)methyl]piperidin-3-yl]pyridin-2-amine
CID 110257105
3-[[(3S)-1-[(1-methylimidazol-2-yl)methyl]pyrrolidin-3-yl]methyl]quinoline
CID 95828246
(3aS,6aR)-2-[(1-methylimidazol-2-yl)methyl]-5-[(6-methyl-2-pyridinyl)methyl]-3,3a,6,6a-tetrahydro-1H-pyrrolo[3,4-c]pyrrol-4-one
CID 124815355
3-[[1-[(1-methylimidazol-2-yl)methyl]pyrrolidin-3-yl]methyl]quinoline
CID 110258647
2-methyl-N-[[1-[(1-methylimidazol-2-yl)methyl]piperidin-3-yl]methyl]propan-2-amine
CID 63847439
1-(cyclobutylmethyl)-3-[(1-methylimidazol-2-yl)methyl]piperidine
CID 86771066

Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-[[1-[(1-methylimidazol-2-yl)methyl]piperidin-3-yl]methyl]pyridine?
The IUPAC name of 2-methyl-6-[[1-[(1-methylimidazol-2-yl)methyl]piperidin-3-yl]methyl]pyridine (CID 127246408) is 2-methyl-6-[[1-[(1-methylimidazol-2-yl)methyl]piperidin-3-yl]methyl]pyridine.
What is the SMILES notation for 2-methyl-6-[[1-[(1-methylimidazol-2-yl)methyl]piperidin-3-yl]methyl]pyridine?
The canonical SMILES for 2-methyl-6-[[1-[(1-methylimidazol-2-yl)methyl]piperidin-3-yl]methyl]pyridine is Cc1cccc(CC2CCCN(Cc3nccn3C)C2)n1.
What is the InChIKey of 2-methyl-6-[[1-[(1-methylimidazol-2-yl)methyl]piperidin-3-yl]methyl]pyridine?
The InChIKey is ZNEISVQNXHFGAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N4/c1-14-5-3-7-16(19-14)11-15-6-4-9-21(12-15)13-17-18-8-10-20(17)2/h3,5,7-8,10,15H,4,6,9,11-13H2,1-2H3.
What are the key properties of 2-methyl-6-[[1-[(1-methylimidazol-2-yl)methyl]piperidin-3-yl]methyl]pyridine?
2-methyl-6-[[1-[(1-methylimidazol-2-yl)methyl]piperidin-3-yl]methyl]pyridine has a molecular weight of 284.41 g/mol, XLogP of 2.58, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-[[1-[(1-methylimidazol-2-yl)methyl]piperidin-3-yl]methyl]pyridine is sourced from PubChem (CID 127246408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).