2-cyclobutyl-7-pyrrolidin-1-yl-1H-imidazo[4,5-b]pyridine

C14H18N4 — CID 91013524

IUPAC2-cyclobutyl-7-pyrrolidin-1-yl-1H-imidazo[4,5-b]pyridine
SMILESc1cc(N2CCCC2)c2[nH]c(C3CCC3)nc2n1
InChIInChI=1S/C14H18N4/c1-2-9-18(8-1)11-6-7-15-14-12(11)16-13(17-14)10-4-3-5-10/h6-7,10H,1-5,8-9H2,(H,15,16,17)
InChIKeyBSVKMMUXGZBXHA-UHFFFAOYSA-N
MW242.33 g/mol
LogP2.83
Rot. Bonds2

About 2-cyclobutyl-7-pyrrolidin-1-yl-1H-imidazo[4,5-b]pyridine

2-cyclobutyl-7-pyrrolidin-1-yl-1H-imidazo[4,5-b]pyridine (PubChem CID 91013524) has the molecular formula C14H18N4 and a molecular weight of 242.33 g/mol. Its IUPAC name is 2-cyclobutyl-7-pyrrolidin-1-yl-1H-imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name2-cyclobutyl-7-pyrrolidin-1-yl-1H-imidazo[4,5-b]pyridine
PubChem CID91013524
Molecular FormulaC14H18N4
Molecular Weight242.33 g/mol
Exact Mass242.15
IUPAC Name2-cyclobutyl-7-pyrrolidin-1-yl-1H-imidazo[4,5-b]pyridine
SMILESc1cc(N2CCCC2)c2[nH]c(C3CCC3)nc2n1
InChIInChI=1S/C14H18N4/c1-2-9-18(8-1)11-6-7-15-14-12(11)16-13(17-14)10-4-3-5-10/h6-7,10H,1-5,8-9H2,(H,15,16,17)
InChIKeyBSVKMMUXGZBXHA-UHFFFAOYSA-N
XLogP2.83
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.33
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-cyclobutyl-7-pyrrolidin-1-yl-1H-imidazo[4,5-b]pyridine?
The IUPAC name of 2-cyclobutyl-7-pyrrolidin-1-yl-1H-imidazo[4,5-b]pyridine (CID 91013524) is 2-cyclobutyl-7-pyrrolidin-1-yl-1H-imidazo[4,5-b]pyridine.
What is the SMILES notation for 2-cyclobutyl-7-pyrrolidin-1-yl-1H-imidazo[4,5-b]pyridine?
The canonical SMILES for 2-cyclobutyl-7-pyrrolidin-1-yl-1H-imidazo[4,5-b]pyridine is c1cc(N2CCCC2)c2[nH]c(C3CCC3)nc2n1.
What is the InChIKey of 2-cyclobutyl-7-pyrrolidin-1-yl-1H-imidazo[4,5-b]pyridine?
The InChIKey is BSVKMMUXGZBXHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4/c1-2-9-18(8-1)11-6-7-15-14-12(11)16-13(17-14)10-4-3-5-10/h6-7,10H,1-5,8-9H2,(H,15,16,17).
What are the key properties of 2-cyclobutyl-7-pyrrolidin-1-yl-1H-imidazo[4,5-b]pyridine?
2-cyclobutyl-7-pyrrolidin-1-yl-1H-imidazo[4,5-b]pyridine has a molecular weight of 242.33 g/mol, XLogP of 2.83, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclobutyl-7-pyrrolidin-1-yl-1H-imidazo[4,5-b]pyridine is sourced from PubChem (CID 91013524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).