2-methyl-6-[4-(2-piperidin-1-ylethyl)phenyl]-1H-imidazo[4,5-b]pyridine

C20H24N4 — CID 167786191

IUPAC2-methyl-6-[4-(2-piperidin-1-ylethyl)phenyl]-1H-imidazo[4,5-b]pyridine
SMILESCc1nc2ncc(-c3ccc(CCN4CCCCC4)cc3)cc2[nH]1
InChIInChI=1S/C20H24N4/c1-15-22-19-13-18(14-21-20(19)23-15)17-7-5-16(6-8-17)9-12-24-10-3-2-4-11-24/h5-8,13-14H,2-4,9-12H2,1H3,(H,21,22,23)
InChIKeyJNSRLRKVMFZYOC-UHFFFAOYSA-N
MW320.44 g/mol
LogP3.96
Rot. Bonds4

About 2-methyl-6-[4-(2-piperidin-1-ylethyl)phenyl]-1H-imidazo[4,5-b]pyridine

2-methyl-6-[4-(2-piperidin-1-ylethyl)phenyl]-1H-imidazo[4,5-b]pyridine (PubChem CID 167786191) has the molecular formula C20H24N4 and a molecular weight of 320.44 g/mol. Its IUPAC name is 2-methyl-6-[4-(2-piperidin-1-ylethyl)phenyl]-1H-imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name2-methyl-6-[4-(2-piperidin-1-ylethyl)phenyl]-1H-imidazo[4,5-b]pyridine
PubChem CID167786191
Molecular FormulaC20H24N4
Molecular Weight320.44 g/mol
Exact Mass320.20
IUPAC Name2-methyl-6-[4-(2-piperidin-1-ylethyl)phenyl]-1H-imidazo[4,5-b]pyridine
SMILESCc1nc2ncc(-c3ccc(CCN4CCCCC4)cc3)cc2[nH]1
InChIInChI=1S/C20H24N4/c1-15-22-19-13-18(14-21-20(19)23-15)17-7-5-16(6-8-17)9-12-24-10-3-2-4-11-24/h5-8,13-14H,2-4,9-12H2,1H3,(H,21,22,23)
InChIKeyJNSRLRKVMFZYOC-UHFFFAOYSA-N
XLogP3.96
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.44
LogP ≤ 53.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-[4-(2-piperidin-1-ylethyl)phenyl]-1H-imidazo[4,5-b]pyridine?
The IUPAC name of 2-methyl-6-[4-(2-piperidin-1-ylethyl)phenyl]-1H-imidazo[4,5-b]pyridine (CID 167786191) is 2-methyl-6-[4-(2-piperidin-1-ylethyl)phenyl]-1H-imidazo[4,5-b]pyridine.
What is the SMILES notation for 2-methyl-6-[4-(2-piperidin-1-ylethyl)phenyl]-1H-imidazo[4,5-b]pyridine?
The canonical SMILES for 2-methyl-6-[4-(2-piperidin-1-ylethyl)phenyl]-1H-imidazo[4,5-b]pyridine is Cc1nc2ncc(-c3ccc(CCN4CCCCC4)cc3)cc2[nH]1.
What is the InChIKey of 2-methyl-6-[4-(2-piperidin-1-ylethyl)phenyl]-1H-imidazo[4,5-b]pyridine?
The InChIKey is JNSRLRKVMFZYOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N4/c1-15-22-19-13-18(14-21-20(19)23-15)17-7-5-16(6-8-17)9-12-24-10-3-2-4-11-24/h5-8,13-14H,2-4,9-12H2,1H3,(H,21,22,23).
What are the key properties of 2-methyl-6-[4-(2-piperidin-1-ylethyl)phenyl]-1H-imidazo[4,5-b]pyridine?
2-methyl-6-[4-(2-piperidin-1-ylethyl)phenyl]-1H-imidazo[4,5-b]pyridine has a molecular weight of 320.44 g/mol, XLogP of 3.96, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-[4-(2-piperidin-1-ylethyl)phenyl]-1H-imidazo[4,5-b]pyridine is sourced from PubChem (CID 167786191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).