5-methyl-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine

C8H10N2 — CID 143384775

IUPAC5-methyl-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine
SMILESCC1C=c2cc[nH]c2=NC1
InChIInChI=1S/C8H10N2/c1-6-4-7-2-3-9-8(7)10-5-6/h2-4,6H,5H2,1H3,(H,9,10)
InChIKeyCKJOXATYVZFPQY-UHFFFAOYSA-N
MW134.18 g/mol
LogP0.06
Rot. Bonds

About 5-methyl-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine

5-methyl-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine (PubChem CID 143384775) has the molecular formula C8H10N2 and a molecular weight of 134.18 g/mol. Its IUPAC name is 5-methyl-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine.

Molecular Properties

Compound Name5-methyl-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine
PubChem CID143384775
Molecular FormulaC8H10N2
Molecular Weight134.18 g/mol
Exact Mass134.08
IUPAC Name5-methyl-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine
SMILESCC1C=c2cc[nH]c2=NC1
InChIInChI=1S/C8H10N2/c1-6-4-7-2-3-9-8(7)10-5-6/h2-4,6H,5H2,1H3,(H,9,10)
InChIKeyCKJOXATYVZFPQY-UHFFFAOYSA-N
XLogP0.06
TPSA28.15 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.18
LogP ≤ 50.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine?
The IUPAC name of 5-methyl-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine (CID 143384775) is 5-methyl-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine.
What is the SMILES notation for 5-methyl-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine?
The canonical SMILES for 5-methyl-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine is CC1C=c2cc[nH]c2=NC1.
What is the InChIKey of 5-methyl-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine?
The InChIKey is CKJOXATYVZFPQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2/c1-6-4-7-2-3-9-8(7)10-5-6/h2-4,6H,5H2,1H3,(H,9,10).
What are the key properties of 5-methyl-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine?
5-methyl-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine has a molecular weight of 134.18 g/mol, XLogP of 0.06, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine is sourced from PubChem (CID 143384775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).