4-[5-methyl-1-(piperidin-3-ylmethyl)imidazol-2-yl]pyridine

C15H20N4 — CID 90488017

IUPAC4-[5-methyl-1-(piperidin-3-ylmethyl)imidazol-2-yl]pyridine
SMILESCc1cnc(-c2ccncc2)n1CC1CCCNC1
InChIInChI=1S/C15H20N4/c1-12-9-18-15(14-4-7-16-8-5-14)19(12)11-13-3-2-6-17-10-13/h4-5,7-9,13,17H,2-3,6,10-11H2,1H3
InChIKeyZVVXXPPOEIVBQL-UHFFFAOYSA-N
MW256.35 g/mol
LogP2.25
Rot. Bonds3

About 4-[5-methyl-1-(piperidin-3-ylmethyl)imidazol-2-yl]pyridine

4-[5-methyl-1-(piperidin-3-ylmethyl)imidazol-2-yl]pyridine (PubChem CID 90488017) has the molecular formula C15H20N4 and a molecular weight of 256.35 g/mol. Its IUPAC name is 4-[5-methyl-1-(piperidin-3-ylmethyl)imidazol-2-yl]pyridine.

Molecular Properties

Compound Name4-[5-methyl-1-(piperidin-3-ylmethyl)imidazol-2-yl]pyridine
PubChem CID90488017
Molecular FormulaC15H20N4
Molecular Weight256.35 g/mol
Exact Mass256.17
IUPAC Name4-[5-methyl-1-(piperidin-3-ylmethyl)imidazol-2-yl]pyridine
SMILESCc1cnc(-c2ccncc2)n1CC1CCCNC1
InChIInChI=1S/C15H20N4/c1-12-9-18-15(14-4-7-16-8-5-14)19(12)11-13-3-2-6-17-10-13/h4-5,7-9,13,17H,2-3,6,10-11H2,1H3
InChIKeyZVVXXPPOEIVBQL-UHFFFAOYSA-N
XLogP2.25
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[5-methyl-1-(piperidin-3-ylmethyl)imidazol-2-yl]pyridine?
The IUPAC name of 4-[5-methyl-1-(piperidin-3-ylmethyl)imidazol-2-yl]pyridine (CID 90488017) is 4-[5-methyl-1-(piperidin-3-ylmethyl)imidazol-2-yl]pyridine.
What is the SMILES notation for 4-[5-methyl-1-(piperidin-3-ylmethyl)imidazol-2-yl]pyridine?
The canonical SMILES for 4-[5-methyl-1-(piperidin-3-ylmethyl)imidazol-2-yl]pyridine is Cc1cnc(-c2ccncc2)n1CC1CCCNC1.
What is the InChIKey of 4-[5-methyl-1-(piperidin-3-ylmethyl)imidazol-2-yl]pyridine?
The InChIKey is ZVVXXPPOEIVBQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4/c1-12-9-18-15(14-4-7-16-8-5-14)19(12)11-13-3-2-6-17-10-13/h4-5,7-9,13,17H,2-3,6,10-11H2,1H3.
What are the key properties of 4-[5-methyl-1-(piperidin-3-ylmethyl)imidazol-2-yl]pyridine?
4-[5-methyl-1-(piperidin-3-ylmethyl)imidazol-2-yl]pyridine has a molecular weight of 256.35 g/mol, XLogP of 2.25, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-methyl-1-(piperidin-3-ylmethyl)imidazol-2-yl]pyridine is sourced from PubChem (CID 90488017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).