5-methoxy-2-(piperidin-4-yloxymethyl)-1H-imidazo[4,5-b]pyridine

C13H18N4O2 — CID 65484225

IUPAC5-methoxy-2-(piperidin-4-yloxymethyl)-1H-imidazo[4,5-b]pyridine
SMILESCOc1ccc2[nH]c(COC3CCNCC3)nc2n1
InChIInChI=1S/C13H18N4O2/c1-18-12-3-2-10-13(17-12)16-11(15-10)8-19-9-4-6-14-7-5-9/h2-3,9,14H,4-8H2,1H3,(H,15,16,17)
InChIKeyRHIBNOSPKSFSLG-UHFFFAOYSA-N
MW262.31 g/mol
LogP1.24
Rot. Bonds4

About 5-methoxy-2-(piperidin-4-yloxymethyl)-1H-imidazo[4,5-b]pyridine

5-methoxy-2-(piperidin-4-yloxymethyl)-1H-imidazo[4,5-b]pyridine (PubChem CID 65484225) has the molecular formula C13H18N4O2 and a molecular weight of 262.31 g/mol. Its IUPAC name is 5-methoxy-2-(piperidin-4-yloxymethyl)-1H-imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name5-methoxy-2-(piperidin-4-yloxymethyl)-1H-imidazo[4,5-b]pyridine
PubChem CID65484225
Molecular FormulaC13H18N4O2
Molecular Weight262.31 g/mol
Exact Mass262.14
IUPAC Name5-methoxy-2-(piperidin-4-yloxymethyl)-1H-imidazo[4,5-b]pyridine
SMILESCOc1ccc2[nH]c(COC3CCNCC3)nc2n1
InChIInChI=1S/C13H18N4O2/c1-18-12-3-2-10-13(17-12)16-11(15-10)8-19-9-4-6-14-7-5-9/h2-3,9,14H,4-8H2,1H3,(H,15,16,17)
InChIKeyRHIBNOSPKSFSLG-UHFFFAOYSA-N
XLogP1.24
TPSA72.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.31
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-methoxy-2-(piperidin-4-yloxymethyl)-1H-imidazo[4,5-b]pyridine?
The IUPAC name of 5-methoxy-2-(piperidin-4-yloxymethyl)-1H-imidazo[4,5-b]pyridine (CID 65484225) is 5-methoxy-2-(piperidin-4-yloxymethyl)-1H-imidazo[4,5-b]pyridine.
What is the SMILES notation for 5-methoxy-2-(piperidin-4-yloxymethyl)-1H-imidazo[4,5-b]pyridine?
The canonical SMILES for 5-methoxy-2-(piperidin-4-yloxymethyl)-1H-imidazo[4,5-b]pyridine is COc1ccc2[nH]c(COC3CCNCC3)nc2n1.
What is the InChIKey of 5-methoxy-2-(piperidin-4-yloxymethyl)-1H-imidazo[4,5-b]pyridine?
The InChIKey is RHIBNOSPKSFSLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4O2/c1-18-12-3-2-10-13(17-12)16-11(15-10)8-19-9-4-6-14-7-5-9/h2-3,9,14H,4-8H2,1H3,(H,15,16,17).
What are the key properties of 5-methoxy-2-(piperidin-4-yloxymethyl)-1H-imidazo[4,5-b]pyridine?
5-methoxy-2-(piperidin-4-yloxymethyl)-1H-imidazo[4,5-b]pyridine has a molecular weight of 262.31 g/mol, XLogP of 1.24, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-2-(piperidin-4-yloxymethyl)-1H-imidazo[4,5-b]pyridine is sourced from PubChem (CID 65484225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).