1,2-dimethyl-5-propan-2-ylimidazo[4,5-b]pyridine

C11H15N3 — CID 59097694

IUPAC1,2-dimethyl-5-propan-2-ylimidazo[4,5-b]pyridine
SMILESCc1nc2nc(C(C)C)ccc2n1C
InChIInChI=1S/C11H15N3/c1-7(2)9-5-6-10-11(13-9)12-8(3)14(10)4/h5-7H,1-4H3
InChIKeySMLLDOHAIMHUSN-UHFFFAOYSA-N
MW189.26 g/mol
LogP2.40
Rot. Bonds1

About 1,2-dimethyl-5-propan-2-ylimidazo[4,5-b]pyridine

1,2-dimethyl-5-propan-2-ylimidazo[4,5-b]pyridine (PubChem CID 59097694) has the molecular formula C11H15N3 and a molecular weight of 189.26 g/mol. Its IUPAC name is 1,2-dimethyl-5-propan-2-ylimidazo[4,5-b]pyridine.

Molecular Properties

Compound Name1,2-dimethyl-5-propan-2-ylimidazo[4,5-b]pyridine
PubChem CID59097694
Molecular FormulaC11H15N3
Molecular Weight189.26 g/mol
Exact Mass189.13
IUPAC Name1,2-dimethyl-5-propan-2-ylimidazo[4,5-b]pyridine
SMILESCc1nc2nc(C(C)C)ccc2n1C
InChIInChI=1S/C11H15N3/c1-7(2)9-5-6-10-11(13-9)12-8(3)14(10)4/h5-7H,1-4H3
InChIKeySMLLDOHAIMHUSN-UHFFFAOYSA-N
XLogP2.40
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.26
LogP ≤ 52.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1,2-dimethyl-5-propan-2-ylimidazo[4,5-b]pyridine?
The IUPAC name of 1,2-dimethyl-5-propan-2-ylimidazo[4,5-b]pyridine (CID 59097694) is 1,2-dimethyl-5-propan-2-ylimidazo[4,5-b]pyridine.
What is the SMILES notation for 1,2-dimethyl-5-propan-2-ylimidazo[4,5-b]pyridine?
The canonical SMILES for 1,2-dimethyl-5-propan-2-ylimidazo[4,5-b]pyridine is Cc1nc2nc(C(C)C)ccc2n1C.
What is the InChIKey of 1,2-dimethyl-5-propan-2-ylimidazo[4,5-b]pyridine?
The InChIKey is SMLLDOHAIMHUSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3/c1-7(2)9-5-6-10-11(13-9)12-8(3)14(10)4/h5-7H,1-4H3.
What are the key properties of 1,2-dimethyl-5-propan-2-ylimidazo[4,5-b]pyridine?
1,2-dimethyl-5-propan-2-ylimidazo[4,5-b]pyridine has a molecular weight of 189.26 g/mol, XLogP of 2.40, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dimethyl-5-propan-2-ylimidazo[4,5-b]pyridine is sourced from PubChem (CID 59097694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).