6-ethyl-1,2,5,7-tetrahydropyrrolo[3,4-b]pyridine

C9H14N2 — CID 121367118

IUPAC6-ethyl-1,2,5,7-tetrahydropyrrolo[3,4-b]pyridine
SMILESCCN1CC2=C(C1)NCC=C2
InChIInChI=1S/C9H14N2/c1-2-11-6-8-4-3-5-10-9(8)7-11/h3-4,10H,2,5-7H2,1H3
InChIKeyMIZKOUKSTXNOSZ-UHFFFAOYSA-N
MW150.22 g/mol
LogP0.74
Rot. Bonds1

About 6-ethyl-1,2,5,7-tetrahydropyrrolo[3,4-b]pyridine

6-ethyl-1,2,5,7-tetrahydropyrrolo[3,4-b]pyridine (PubChem CID 121367118) has the molecular formula C9H14N2 and a molecular weight of 150.22 g/mol. Its IUPAC name is 6-ethyl-1,2,5,7-tetrahydropyrrolo[3,4-b]pyridine.

Molecular Properties

Compound Name6-ethyl-1,2,5,7-tetrahydropyrrolo[3,4-b]pyridine
PubChem CID121367118
Molecular FormulaC9H14N2
Molecular Weight150.22 g/mol
Exact Mass150.12
IUPAC Name6-ethyl-1,2,5,7-tetrahydropyrrolo[3,4-b]pyridine
SMILESCCN1CC2=C(C1)NCC=C2
InChIInChI=1S/C9H14N2/c1-2-11-6-8-4-3-5-10-9(8)7-11/h3-4,10H,2,5-7H2,1H3
InChIKeyMIZKOUKSTXNOSZ-UHFFFAOYSA-N
XLogP0.74
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.22
LogP ≤ 50.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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5,7-Dimethyl-1h-pyrrolo[2,3-g]quinoline
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2,3-dihydro-1H-cyclopenta[b]pyridine
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2,3,6,7-tetrahydro-1H-pyrrolo[2,3-c]pyridine
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2-(Methylaminomethyl)benzene-4-id-1-amine;yttrium
CID 59094562
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2,5-dihydro-1H-cyclopenta[b]pyridine
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Frequently Asked Questions

What is the IUPAC name of 6-ethyl-1,2,5,7-tetrahydropyrrolo[3,4-b]pyridine?
The IUPAC name of 6-ethyl-1,2,5,7-tetrahydropyrrolo[3,4-b]pyridine (CID 121367118) is 6-ethyl-1,2,5,7-tetrahydropyrrolo[3,4-b]pyridine.
What is the SMILES notation for 6-ethyl-1,2,5,7-tetrahydropyrrolo[3,4-b]pyridine?
The canonical SMILES for 6-ethyl-1,2,5,7-tetrahydropyrrolo[3,4-b]pyridine is CCN1CC2=C(C1)NCC=C2.
What is the InChIKey of 6-ethyl-1,2,5,7-tetrahydropyrrolo[3,4-b]pyridine?
The InChIKey is MIZKOUKSTXNOSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2/c1-2-11-6-8-4-3-5-10-9(8)7-11/h3-4,10H,2,5-7H2,1H3.
What are the key properties of 6-ethyl-1,2,5,7-tetrahydropyrrolo[3,4-b]pyridine?
6-ethyl-1,2,5,7-tetrahydropyrrolo[3,4-b]pyridine has a molecular weight of 150.22 g/mol, XLogP of 0.74, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-1,2,5,7-tetrahydropyrrolo[3,4-b]pyridine is sourced from PubChem (CID 121367118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).