2-[1-[[1-[(1-methylpiperidin-4-yl)methyl]imidazol-2-yl]methyl]pyrrolidin-2-yl]pyridine

C20H29N5 — CID 145424881

IUPAC2-[1-[[1-[(1-methylpiperidin-4-yl)methyl]imidazol-2-yl]methyl]pyrrolidin-2-yl]pyridine
SMILESCN1CCC(Cn2ccnc2CN2CCCC2c2ccccn2)CC1
InChIInChI=1S/C20H29N5/c1-23-12-7-17(8-13-23)15-25-14-10-22-20(25)16-24-11-4-6-19(24)18-5-2-3-9-21-18/h2-3,5,9-10,14,17,19H,4,6-8,11-13,15-16H2,1H3
InChIKeyKLKUFWXTPMZAEP-UHFFFAOYSA-N
MW339.49 g/mol
LogP2.96
Rot. Bonds5

About 2-[1-[[1-[(1-methylpiperidin-4-yl)methyl]imidazol-2-yl]methyl]pyrrolidin-2-yl]pyridine

2-[1-[[1-[(1-methylpiperidin-4-yl)methyl]imidazol-2-yl]methyl]pyrrolidin-2-yl]pyridine (PubChem CID 145424881) has the molecular formula C20H29N5 and a molecular weight of 339.49 g/mol. Its IUPAC name is 2-[1-[[1-[(1-methylpiperidin-4-yl)methyl]imidazol-2-yl]methyl]pyrrolidin-2-yl]pyridine.

Molecular Properties

Compound Name2-[1-[[1-[(1-methylpiperidin-4-yl)methyl]imidazol-2-yl]methyl]pyrrolidin-2-yl]pyridine
PubChem CID145424881
Molecular FormulaC20H29N5
Molecular Weight339.49 g/mol
Exact Mass339.24
IUPAC Name2-[1-[[1-[(1-methylpiperidin-4-yl)methyl]imidazol-2-yl]methyl]pyrrolidin-2-yl]pyridine
SMILESCN1CCC(Cn2ccnc2CN2CCCC2c2ccccn2)CC1
InChIInChI=1S/C20H29N5/c1-23-12-7-17(8-13-23)15-25-14-10-22-20(25)16-24-11-4-6-19(24)18-5-2-3-9-21-18/h2-3,5,9-10,14,17,19H,4,6-8,11-13,15-16H2,1H3
InChIKeyKLKUFWXTPMZAEP-UHFFFAOYSA-N
XLogP2.96
TPSA37.19 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.49
LogP ≤ 52.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 2-[1-[[1-[(1-methylpiperidin-4-yl)methyl]imidazol-2-yl]methyl]pyrrolidin-2-yl]pyridine with MolForge

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Related Compounds

3-methyl-2-[1-[[1-[(1-methylpiperidin-4-yl)methyl]imidazol-2-yl]methyl]pyrrolidin-2-yl]pyridine
CID 145424909
2-[1-[3-(2-methylimidazol-1-yl)propyl]pyrrolidin-2-yl]pyridine
CID 91830276
2-[(2R)-1-[(1-methylpyrazol-4-yl)methyl]pyrrolidin-2-yl]pyridine
CID 95730792
4-[1-[(1-methylimidazol-2-yl)methyl]pyrrolidin-2-yl]pyrimidine
CID 110254306
4-[(2S)-1-[(1-methylimidazol-2-yl)methyl]pyrrolidin-2-yl]pyrimidine
CID 95817567
8-fluoro-3-(4-methylpiperazin-1-yl)-2-[(2-pyridin-2-ylpyrrolidin-1-yl)methyl]imidazo[1,2-a]pyridine
CID 145424877
7-fluoro-3-(4-methylpiperazin-1-yl)-2-[(2-pyridin-2-ylpyrrolidin-1-yl)methyl]imidazo[1,2-a]pyridine
CID 145424929
4-[(2R)-1-[(1-benzylimidazol-2-yl)methyl]pyrrolidin-2-yl]-1,3,5-trimethylpyrazole
CID 95750793
2-[(2-pyridin-2-ylpiperidin-1-yl)methyl]-1,3-thiazole
CID 77081994
2-[(2S)-1-(pyridin-3-ylmethyl)pyrrolidin-2-yl]pyridine
CID 95841459
2-methyl-6-[1-[(1-methylimidazol-2-yl)methyl]piperidin-2-yl]-N-pyridin-2-ylpyrimidin-4-amine
CID 110095461
1-[(1-methylpiperidin-4-yl)methyl]-N-propan-2-ylimidazol-2-amine
CID 106567048

Frequently Asked Questions

What is the IUPAC name of 2-[1-[[1-[(1-methylpiperidin-4-yl)methyl]imidazol-2-yl]methyl]pyrrolidin-2-yl]pyridine?
The IUPAC name of 2-[1-[[1-[(1-methylpiperidin-4-yl)methyl]imidazol-2-yl]methyl]pyrrolidin-2-yl]pyridine (CID 145424881) is 2-[1-[[1-[(1-methylpiperidin-4-yl)methyl]imidazol-2-yl]methyl]pyrrolidin-2-yl]pyridine.
What is the SMILES notation for 2-[1-[[1-[(1-methylpiperidin-4-yl)methyl]imidazol-2-yl]methyl]pyrrolidin-2-yl]pyridine?
The canonical SMILES for 2-[1-[[1-[(1-methylpiperidin-4-yl)methyl]imidazol-2-yl]methyl]pyrrolidin-2-yl]pyridine is CN1CCC(Cn2ccnc2CN2CCCC2c2ccccn2)CC1.
What is the InChIKey of 2-[1-[[1-[(1-methylpiperidin-4-yl)methyl]imidazol-2-yl]methyl]pyrrolidin-2-yl]pyridine?
The InChIKey is KLKUFWXTPMZAEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H29N5/c1-23-12-7-17(8-13-23)15-25-14-10-22-20(25)16-24-11-4-6-19(24)18-5-2-3-9-21-18/h2-3,5,9-10,14,17,19H,4,6-8,11-13,15-16H2,1H3.
What are the key properties of 2-[1-[[1-[(1-methylpiperidin-4-yl)methyl]imidazol-2-yl]methyl]pyrrolidin-2-yl]pyridine?
2-[1-[[1-[(1-methylpiperidin-4-yl)methyl]imidazol-2-yl]methyl]pyrrolidin-2-yl]pyridine has a molecular weight of 339.49 g/mol, XLogP of 2.96, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[[1-[(1-methylpiperidin-4-yl)methyl]imidazol-2-yl]methyl]pyrrolidin-2-yl]pyridine is sourced from PubChem (CID 145424881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).