2-[1-[[(3R)-1-[(2,3-dimethylimidazol-4-yl)methyl]piperidin-3-yl]methyl]triazol-4-yl]pyridine

C19H25N7 — CID 29025684

IUPAC2-[1-[[(3R)-1-[(2,3-dimethylimidazol-4-yl)methyl]piperidin-3-yl]methyl]triazol-4-yl]pyridine
SMILESCc1ncc(CN2CCC[C@@H](Cn3cc(-c4ccccn4)nn3)C2)n1C
InChIInChI=1S/C19H25N7/c1-15-21-10-17(24(15)2)13-25-9-5-6-16(11-25)12-26-14-19(22-23-26)18-7-3-4-8-20-18/h3-4,7-8,10,14,16H,5-6,9,11-13H2,1-2H3/t16-/m1/s1
InChIKeyRYSXGISTTDNIHZ-MRXNPFEDSA-N
MW351.46 g/mol
LogP2.29
Rot. Bonds5

About 2-[1-[[(3R)-1-[(2,3-dimethylimidazol-4-yl)methyl]piperidin-3-yl]methyl]triazol-4-yl]pyridine

2-[1-[[(3R)-1-[(2,3-dimethylimidazol-4-yl)methyl]piperidin-3-yl]methyl]triazol-4-yl]pyridine (PubChem CID 29025684) has the molecular formula C19H25N7 and a molecular weight of 351.46 g/mol. Its IUPAC name is 2-[1-[[(3R)-1-[(2,3-dimethylimidazol-4-yl)methyl]piperidin-3-yl]methyl]triazol-4-yl]pyridine.

Molecular Properties

Compound Name2-[1-[[(3R)-1-[(2,3-dimethylimidazol-4-yl)methyl]piperidin-3-yl]methyl]triazol-4-yl]pyridine
PubChem CID29025684
Molecular FormulaC19H25N7
Molecular Weight351.46 g/mol
Exact Mass351.22
IUPAC Name2-[1-[[(3R)-1-[(2,3-dimethylimidazol-4-yl)methyl]piperidin-3-yl]methyl]triazol-4-yl]pyridine
SMILESCc1ncc(CN2CCC[C@@H](Cn3cc(-c4ccccn4)nn3)C2)n1C
InChIInChI=1S/C19H25N7/c1-15-21-10-17(24(15)2)13-25-9-5-6-16(11-25)12-26-14-19(22-23-26)18-7-3-4-8-20-18/h3-4,7-8,10,14,16H,5-6,9,11-13H2,1-2H3/t16-/m1/s1
InChIKeyRYSXGISTTDNIHZ-MRXNPFEDSA-N
XLogP2.29
TPSA64.66 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.46
LogP ≤ 52.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 2-[1-[[(3R)-1-[(2,3-dimethylimidazol-4-yl)methyl]piperidin-3-yl]methyl]triazol-4-yl]pyridine with MolForge

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Related Compounds

2-[1-[[1-[(5-methyl-1H-imidazol-4-yl)methyl]piperidin-3-yl]methyl]triazol-4-yl]pyridine
CID 45205228
[1-[[1-[(1-pyridin-2-ylpyrrol-2-yl)methyl]piperidin-3-yl]methyl]triazol-4-yl]methanamine
CID 45243962
(3R)-3-[[4-(4-fluorophenyl)triazol-1-yl]methyl]-1-(1H-imidazol-2-ylmethyl)piperidine
CID 29170107
[1-[[(3S)-1-[(5-methyl-1H-imidazol-2-yl)methyl]piperidin-3-yl]methyl]triazol-4-yl]methanol
CID 28737834
[(3S)-1-[1-[(2,3-dimethylimidazol-4-yl)methyl]piperidin-4-yl]piperidin-3-yl]methanol
CID 99948168
[1-[[1-[(2-phenyl-1,3-thiazol-5-yl)methyl]piperidin-3-yl]methyl]triazol-4-yl]methanamine
CID 45227302
2-[[(3S)-3-[(3,5-dimethyl-1,2,4-triazol-1-yl)methyl]piperidin-1-yl]methyl]pyridine
CID 95317619
2-[1-[(4-methylphenyl)methyl]triazol-4-yl]pyridine
CID 102291275
[1-[[1-[[2-(furan-2-yl)phenyl]methyl]piperidin-3-yl]methyl]triazol-4-yl]methanamine
CID 45234763
(3S)-1-[(4-fluorophenyl)methyl]-3-[[4-(methoxymethyl)triazol-1-yl]methyl]piperidine
CID 31135460
[1-[[(3R)-1-[(5-chloro-1,3-dimethylpyrazol-4-yl)methyl]piperidin-3-yl]methyl]triazol-4-yl]methanol
CID 28906323
[1-[[1-[(4-pyrazol-1-ylphenyl)methyl]piperidin-3-yl]methyl]triazol-4-yl]methanol
CID 45209928

Frequently Asked Questions

What is the IUPAC name of 2-[1-[[(3R)-1-[(2,3-dimethylimidazol-4-yl)methyl]piperidin-3-yl]methyl]triazol-4-yl]pyridine?
The IUPAC name of 2-[1-[[(3R)-1-[(2,3-dimethylimidazol-4-yl)methyl]piperidin-3-yl]methyl]triazol-4-yl]pyridine (CID 29025684) is 2-[1-[[(3R)-1-[(2,3-dimethylimidazol-4-yl)methyl]piperidin-3-yl]methyl]triazol-4-yl]pyridine.
What is the SMILES notation for 2-[1-[[(3R)-1-[(2,3-dimethylimidazol-4-yl)methyl]piperidin-3-yl]methyl]triazol-4-yl]pyridine?
The canonical SMILES for 2-[1-[[(3R)-1-[(2,3-dimethylimidazol-4-yl)methyl]piperidin-3-yl]methyl]triazol-4-yl]pyridine is Cc1ncc(CN2CCC[C@@H](Cn3cc(-c4ccccn4)nn3)C2)n1C.
What is the InChIKey of 2-[1-[[(3R)-1-[(2,3-dimethylimidazol-4-yl)methyl]piperidin-3-yl]methyl]triazol-4-yl]pyridine?
The InChIKey is RYSXGISTTDNIHZ-MRXNPFEDSA-N. The full InChI is InChI=1S/C19H25N7/c1-15-21-10-17(24(15)2)13-25-9-5-6-16(11-25)12-26-14-19(22-23-26)18-7-3-4-8-20-18/h3-4,7-8,10,14,16H,5-6,9,11-13H2,1-2H3/t16-/m1/s1.
What are the key properties of 2-[1-[[(3R)-1-[(2,3-dimethylimidazol-4-yl)methyl]piperidin-3-yl]methyl]triazol-4-yl]pyridine?
2-[1-[[(3R)-1-[(2,3-dimethylimidazol-4-yl)methyl]piperidin-3-yl]methyl]triazol-4-yl]pyridine has a molecular weight of 351.46 g/mol, XLogP of 2.29, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[[(3R)-1-[(2,3-dimethylimidazol-4-yl)methyl]piperidin-3-yl]methyl]triazol-4-yl]pyridine is sourced from PubChem (CID 29025684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).