2-methyl-7-piperidin-4-yl-1H-imidazo[4,5-b]pyridine

C12H16N4 — CID 84681943

IUPAC2-methyl-7-piperidin-4-yl-1H-imidazo[4,5-b]pyridine
SMILESCc1nc2nccc(C3CCNCC3)c2[nH]1
InChIInChI=1S/C12H16N4/c1-8-15-11-10(4-7-14-12(11)16-8)9-2-5-13-6-3-9/h4,7,9,13H,2-3,5-6H2,1H3,(H,14,15,16)
InChIKeyVDGFGWBJTLTYKA-UHFFFAOYSA-N
MW216.29 g/mol
LogP1.73
Rot. Bonds1

About 2-methyl-7-piperidin-4-yl-1H-imidazo[4,5-b]pyridine

2-methyl-7-piperidin-4-yl-1H-imidazo[4,5-b]pyridine (PubChem CID 84681943) has the molecular formula C12H16N4 and a molecular weight of 216.29 g/mol. Its IUPAC name is 2-methyl-7-piperidin-4-yl-1H-imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name2-methyl-7-piperidin-4-yl-1H-imidazo[4,5-b]pyridine
PubChem CID84681943
Molecular FormulaC12H16N4
Molecular Weight216.29 g/mol
Exact Mass216.14
IUPAC Name2-methyl-7-piperidin-4-yl-1H-imidazo[4,5-b]pyridine
SMILESCc1nc2nccc(C3CCNCC3)c2[nH]1
InChIInChI=1S/C12H16N4/c1-8-15-11-10(4-7-14-12(11)16-8)9-2-5-13-6-3-9/h4,7,9,13H,2-3,5-6H2,1H3,(H,14,15,16)
InChIKeyVDGFGWBJTLTYKA-UHFFFAOYSA-N
XLogP1.73
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.29
LogP ≤ 51.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-7-piperidin-4-yl-1H-imidazo[4,5-b]pyridine?
The IUPAC name of 2-methyl-7-piperidin-4-yl-1H-imidazo[4,5-b]pyridine (CID 84681943) is 2-methyl-7-piperidin-4-yl-1H-imidazo[4,5-b]pyridine.
What is the SMILES notation for 2-methyl-7-piperidin-4-yl-1H-imidazo[4,5-b]pyridine?
The canonical SMILES for 2-methyl-7-piperidin-4-yl-1H-imidazo[4,5-b]pyridine is Cc1nc2nccc(C3CCNCC3)c2[nH]1.
What is the InChIKey of 2-methyl-7-piperidin-4-yl-1H-imidazo[4,5-b]pyridine?
The InChIKey is VDGFGWBJTLTYKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N4/c1-8-15-11-10(4-7-14-12(11)16-8)9-2-5-13-6-3-9/h4,7,9,13H,2-3,5-6H2,1H3,(H,14,15,16).
What are the key properties of 2-methyl-7-piperidin-4-yl-1H-imidazo[4,5-b]pyridine?
2-methyl-7-piperidin-4-yl-1H-imidazo[4,5-b]pyridine has a molecular weight of 216.29 g/mol, XLogP of 1.73, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-7-piperidin-4-yl-1H-imidazo[4,5-b]pyridine is sourced from PubChem (CID 84681943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).