2-ethyl-6-methyl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine

C10H14N2 — CID 118493377

IUPAC2-ethyl-6-methyl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine
SMILESCCC1=CC2N=CC(C)=CC2N1
InChIInChI=1S/C10H14N2/c1-3-8-5-9-10(12-8)4-7(2)6-11-9/h4-6,9-10,12H,3H2,1-2H3
InChIKeyOQTIOBJGENWFKU-UHFFFAOYSA-N
MW162.24 g/mol
LogP1.65
Rot. Bonds1

About 2-ethyl-6-methyl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine

2-ethyl-6-methyl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine (PubChem CID 118493377) has the molecular formula C10H14N2 and a molecular weight of 162.24 g/mol. Its IUPAC name is 2-ethyl-6-methyl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine.

Molecular Properties

Compound Name2-ethyl-6-methyl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine
PubChem CID118493377
Molecular FormulaC10H14N2
Molecular Weight162.24 g/mol
Exact Mass162.12
IUPAC Name2-ethyl-6-methyl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine
SMILESCCC1=CC2N=CC(C)=CC2N1
InChIInChI=1S/C10H14N2/c1-3-8-5-9-10(12-8)4-7(2)6-11-9/h4-6,9-10,12H,3H2,1-2H3
InChIKeyOQTIOBJGENWFKU-UHFFFAOYSA-N
XLogP1.65
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.24
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-ethyl-6-fluoro-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine
CID 117611844
6-fluoro-2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine
CID 118489342
5-fluoro-2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine
CID 118489346
6-fluoro-2-methyl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine
CID 118491774
5-fluoro-2-methyl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine
CID 118491786
2,4-dimethyl-2,3-dihydro-1H-pyrrolo[3,4-b]pyridine
CID 19826769
2-methyl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine
CID 23545925
N-(3,4-dihydropyridin-6-ylmethyl)propan-2-amine
CID 89002162
2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine
CID 118489343
2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-c]pyridine
CID 118489344
6-chloro-2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine
CID 118489348
5-methyl-2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine
CID 118489357

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-6-methyl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine?
The IUPAC name of 2-ethyl-6-methyl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine (CID 118493377) is 2-ethyl-6-methyl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine.
What is the SMILES notation for 2-ethyl-6-methyl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine?
The canonical SMILES for 2-ethyl-6-methyl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine is CCC1=CC2N=CC(C)=CC2N1.
What is the InChIKey of 2-ethyl-6-methyl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine?
The InChIKey is OQTIOBJGENWFKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2/c1-3-8-5-9-10(12-8)4-7(2)6-11-9/h4-6,9-10,12H,3H2,1-2H3.
What are the key properties of 2-ethyl-6-methyl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine?
2-ethyl-6-methyl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine has a molecular weight of 162.24 g/mol, XLogP of 1.65, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-6-methyl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine is sourced from PubChem (CID 118493377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).