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

C9H12N2 — CID 142308845

IUPAC2-ethyl-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine
SMILESCCc1cc2c([nH]1)=NCCC=2
InChIInChI=1S/C9H12N2/c1-2-8-6-7-4-3-5-10-9(7)11-8/h4,6H,2-3,5H2,1H3,(H,10,11)
InChIKeyXGTITYHEXFRXAM-UHFFFAOYSA-N
MW148.21 g/mol
LogP0.38
Rot. Bonds1

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

2-ethyl-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine (PubChem CID 142308845) has the molecular formula C9H12N2 and a molecular weight of 148.21 g/mol. Its IUPAC name is 2-ethyl-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine.

Molecular Properties

Compound Name2-ethyl-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine
PubChem CID142308845
Molecular FormulaC9H12N2
Molecular Weight148.21 g/mol
Exact Mass148.10
IUPAC Name2-ethyl-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine
SMILESCCc1cc2c([nH]1)=NCCC=2
InChIInChI=1S/C9H12N2/c1-2-8-6-7-4-3-5-10-9(7)11-8/h4,6H,2-3,5H2,1H3,(H,10,11)
InChIKeyXGTITYHEXFRXAM-UHFFFAOYSA-N
XLogP0.38
TPSA28.15 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.21
LogP ≤ 50.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(2-fluoropropan-2-yl)-2-methyl-6-methylidene-1,5-dihydropyrrolo[2,3-b]pyridin-3-amine
CID 137305119
5-fluoro-2-methyl-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine
CID 142309044
4-Fluoro-1,2-dimethyl-5,6-dihydropyrrolo[2,3-b]pyridine
CID 155197749
2-[2-(6-fluorocyclohexa-1,5-dien-1-yl)ethynyl]-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine
CID 155197927
6-Fluoro-1,2-dimethyl-5,6-dihydropyrrolo[2,3-b]pyridine
CID 142309011
8-But-1-en-2-yl-3-(trifluoromethyl)-7,9-diazabicyclo[4.3.1]deca-1(10),2,4,7-tetraene
CID 144414912
1,2,4-trimethyl-3-tritio-6H-pyrrolo[2,3-b]pyridin-6-ide;yttrium
CID 59708866
4,6,7-trimethyl-5-tritio-2H-pyrrolo[2,3-d]pyrimidin-2-ide;yttrium
CID 59708926
6-but-2-en-2-yl-2-methyl-4,5-dihydro-1H-pyrimidin-5-ide;yttrium
CID 59890254
(2-methyl-7,7a-dihydro-3H-benzimidazol-5-yl)methanamine
CID 70224389
2-methyl-7,7a-dihydro-3H-benzimidazole-5-carboximidamide
CID 70226335
5-Methyl-2,6-dihydropyrrolo[2,3-b]pyrrole
CID 70640497

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine?
The IUPAC name of 2-ethyl-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine (CID 142308845) is 2-ethyl-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine.
What is the SMILES notation for 2-ethyl-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine?
The canonical SMILES for 2-ethyl-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine is CCc1cc2c([nH]1)=NCCC=2.
What is the InChIKey of 2-ethyl-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine?
The InChIKey is XGTITYHEXFRXAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2/c1-2-8-6-7-4-3-5-10-9(7)11-8/h4,6H,2-3,5H2,1H3,(H,10,11).
What are the key properties of 2-ethyl-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine?
2-ethyl-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine has a molecular weight of 148.21 g/mol, XLogP of 0.38, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine is sourced from PubChem (CID 142308845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).