7-methyl-7,7a-dihydro-4H-imidazo[4,5-b]pyridine

C7H9N3 — CID 147029554

IUPAC7-methyl-7,7a-dihydro-4H-imidazo[4,5-b]pyridine
SMILESCC1C=CNC2=NC=NC21
InChIInChI=1S/C7H9N3/c1-5-2-3-8-7-6(5)9-4-10-7/h2-6H,1H3,(H,8,9,10)
InChIKeyAXIBRNFCMDLMNC-UHFFFAOYSA-N
MW135.17 g/mol
LogP0.55
Rot. Bonds

About 7-methyl-7,7a-dihydro-4H-imidazo[4,5-b]pyridine

7-methyl-7,7a-dihydro-4H-imidazo[4,5-b]pyridine (PubChem CID 147029554) has the molecular formula C7H9N3 and a molecular weight of 135.17 g/mol. Its IUPAC name is 7-methyl-7,7a-dihydro-4H-imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name7-methyl-7,7a-dihydro-4H-imidazo[4,5-b]pyridine
PubChem CID147029554
Molecular FormulaC7H9N3
Molecular Weight135.17 g/mol
Exact Mass135.08
IUPAC Name7-methyl-7,7a-dihydro-4H-imidazo[4,5-b]pyridine
SMILESCC1C=CNC2=NC=NC21
InChIInChI=1S/C7H9N3/c1-5-2-3-8-7-6(5)9-4-10-7/h2-6H,1H3,(H,8,9,10)
InChIKeyAXIBRNFCMDLMNC-UHFFFAOYSA-N
XLogP0.55
TPSA36.75 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.17
LogP ≤ 50.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7-methyl-7,7a-dihydro-4H-imidazo[4,5-b]pyridine?
The IUPAC name of 7-methyl-7,7a-dihydro-4H-imidazo[4,5-b]pyridine (CID 147029554) is 7-methyl-7,7a-dihydro-4H-imidazo[4,5-b]pyridine.
What is the SMILES notation for 7-methyl-7,7a-dihydro-4H-imidazo[4,5-b]pyridine?
The canonical SMILES for 7-methyl-7,7a-dihydro-4H-imidazo[4,5-b]pyridine is CC1C=CNC2=NC=NC21.
What is the InChIKey of 7-methyl-7,7a-dihydro-4H-imidazo[4,5-b]pyridine?
The InChIKey is AXIBRNFCMDLMNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3/c1-5-2-3-8-7-6(5)9-4-10-7/h2-6H,1H3,(H,8,9,10).
What are the key properties of 7-methyl-7,7a-dihydro-4H-imidazo[4,5-b]pyridine?
7-methyl-7,7a-dihydro-4H-imidazo[4,5-b]pyridine has a molecular weight of 135.17 g/mol, XLogP of 0.55, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-7,7a-dihydro-4H-imidazo[4,5-b]pyridine is sourced from PubChem (CID 147029554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).