5-methyl-2,3-dihydro-1H-imidazo[4,5-b]pyridine;molecular hydrogen

C7H13N3 — CID 178139662

IUPAC5-methyl-2,3-dihydro-1H-imidazo[4,5-b]pyridine;molecular hydrogen
SMILESCc1ccc2c(n1)NCN2.[H][H].[H][H]
InChIInChI=1S/C7H9N3.2H2/c1-5-2-3-6-7(10-5)9-4-8-6;;/h2-3,8H,4H2,1H3,(H,9,10);2*1H
InChIKeyYFHAVLQZOCTGBR-UHFFFAOYSA-N
MW139.20 g/mol
LogP1.68
Rot. Bonds

About 5-methyl-2,3-dihydro-1H-imidazo[4,5-b]pyridine;molecular hydrogen

5-methyl-2,3-dihydro-1H-imidazo[4,5-b]pyridine;molecular hydrogen (PubChem CID 178139662) has the molecular formula C7H13N3 and a molecular weight of 139.20 g/mol. Its IUPAC name is 5-methyl-2,3-dihydro-1H-imidazo[4,5-b]pyridine;molecular hydrogen.

Molecular Properties

Compound Name5-methyl-2,3-dihydro-1H-imidazo[4,5-b]pyridine;molecular hydrogen
PubChem CID178139662
Molecular FormulaC7H13N3
Molecular Weight139.20 g/mol
Exact Mass139.11
IUPAC Name5-methyl-2,3-dihydro-1H-imidazo[4,5-b]pyridine;molecular hydrogen
SMILESCc1ccc2c(n1)NCN2.[H][H].[H][H]
InChIInChI=1S/C7H9N3.2H2/c1-5-2-3-6-7(10-5)9-4-8-6;;/h2-3,8H,4H2,1H3,(H,9,10);2*1H
InChIKeyYFHAVLQZOCTGBR-UHFFFAOYSA-N
XLogP1.68
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.20
LogP ≤ 51.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-2,3-dihydro-1H-imidazo[4,5-b]pyridine;molecular hydrogen?
The IUPAC name of 5-methyl-2,3-dihydro-1H-imidazo[4,5-b]pyridine;molecular hydrogen (CID 178139662) is 5-methyl-2,3-dihydro-1H-imidazo[4,5-b]pyridine;molecular hydrogen.
What is the SMILES notation for 5-methyl-2,3-dihydro-1H-imidazo[4,5-b]pyridine;molecular hydrogen?
The canonical SMILES for 5-methyl-2,3-dihydro-1H-imidazo[4,5-b]pyridine;molecular hydrogen is Cc1ccc2c(n1)NCN2.[H][H].[H][H].
What is the InChIKey of 5-methyl-2,3-dihydro-1H-imidazo[4,5-b]pyridine;molecular hydrogen?
The InChIKey is YFHAVLQZOCTGBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3.2H2/c1-5-2-3-6-7(10-5)9-4-8-6;;/h2-3,8H,4H2,1H3,(H,9,10);2*1H.
What are the key properties of 5-methyl-2,3-dihydro-1H-imidazo[4,5-b]pyridine;molecular hydrogen?
5-methyl-2,3-dihydro-1H-imidazo[4,5-b]pyridine;molecular hydrogen has a molecular weight of 139.20 g/mol, XLogP of 1.68, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2,3-dihydro-1H-imidazo[4,5-b]pyridine;molecular hydrogen is sourced from PubChem (CID 178139662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).