6-methyl-3,4,5,7-tetrahydropyrrolo[2,3-c]pyridine

C8H12N2 — CID 58223119

IUPAC6-methyl-3,4,5,7-tetrahydropyrrolo[2,3-c]pyridine
SMILESCN1CCC2=C(C1)N=CC2
InChIInChI=1S/C8H12N2/c1-10-5-3-7-2-4-9-8(7)6-10/h4H,2-3,5-6H2,1H3
InChIKeyAZKHGCLYHMUULR-UHFFFAOYSA-N
MW136.20 g/mol
LogP1.05
Rot. Bonds

About 6-methyl-3,4,5,7-tetrahydropyrrolo[2,3-c]pyridine

6-methyl-3,4,5,7-tetrahydropyrrolo[2,3-c]pyridine (PubChem CID 58223119) has the molecular formula C8H12N2 and a molecular weight of 136.20 g/mol. Its IUPAC name is 6-methyl-3,4,5,7-tetrahydropyrrolo[2,3-c]pyridine.

Molecular Properties

Compound Name6-methyl-3,4,5,7-tetrahydropyrrolo[2,3-c]pyridine
PubChem CID58223119
Molecular FormulaC8H12N2
Molecular Weight136.20 g/mol
Exact Mass136.10
IUPAC Name6-methyl-3,4,5,7-tetrahydropyrrolo[2,3-c]pyridine
SMILESCN1CCC2=C(C1)N=CC2
InChIInChI=1S/C8H12N2/c1-10-5-3-7-2-4-9-8(7)6-10/h4H,2-3,5-6H2,1H3
InChIKeyAZKHGCLYHMUULR-UHFFFAOYSA-N
XLogP1.05
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.20
LogP ≤ 51.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-3,4,5,7-tetrahydropyrrolo[2,3-c]pyridine?
The IUPAC name of 6-methyl-3,4,5,7-tetrahydropyrrolo[2,3-c]pyridine (CID 58223119) is 6-methyl-3,4,5,7-tetrahydropyrrolo[2,3-c]pyridine.
What is the SMILES notation for 6-methyl-3,4,5,7-tetrahydropyrrolo[2,3-c]pyridine?
The canonical SMILES for 6-methyl-3,4,5,7-tetrahydropyrrolo[2,3-c]pyridine is CN1CCC2=C(C1)N=CC2.
What is the InChIKey of 6-methyl-3,4,5,7-tetrahydropyrrolo[2,3-c]pyridine?
The InChIKey is AZKHGCLYHMUULR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2/c1-10-5-3-7-2-4-9-8(7)6-10/h4H,2-3,5-6H2,1H3.
What are the key properties of 6-methyl-3,4,5,7-tetrahydropyrrolo[2,3-c]pyridine?
6-methyl-3,4,5,7-tetrahydropyrrolo[2,3-c]pyridine has a molecular weight of 136.20 g/mol, XLogP of 1.05, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-3,4,5,7-tetrahydropyrrolo[2,3-c]pyridine is sourced from PubChem (CID 58223119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).