2-ethyl-3aH-pyrrolo[2,3-c]pyridine

C9H10N2 — CID 156793397

IUPAC2-ethyl-3aH-pyrrolo[2,3-c]pyridine
SMILESCCC1=CC2C=CN=CC2=N1
InChIInChI=1S/C9H10N2/c1-2-8-5-7-3-4-10-6-9(7)11-8/h3-7H,2H2,1H3
InChIKeyNOIUBSWAUDCGCN-UHFFFAOYSA-N
MW146.19 g/mol
LogP1.95
Rot. Bonds1

About 2-ethyl-3aH-pyrrolo[2,3-c]pyridine

2-ethyl-3aH-pyrrolo[2,3-c]pyridine (PubChem CID 156793397) has the molecular formula C9H10N2 and a molecular weight of 146.19 g/mol. Its IUPAC name is 2-ethyl-3aH-pyrrolo[2,3-c]pyridine.

Molecular Properties

Compound Name2-ethyl-3aH-pyrrolo[2,3-c]pyridine
PubChem CID156793397
Molecular FormulaC9H10N2
Molecular Weight146.19 g/mol
Exact Mass146.08
IUPAC Name2-ethyl-3aH-pyrrolo[2,3-c]pyridine
SMILESCCC1=CC2C=CN=CC2=N1
InChIInChI=1S/C9H10N2/c1-2-8-5-7-3-4-10-6-9(7)11-8/h3-7H,2H2,1H3
InChIKeyNOIUBSWAUDCGCN-UHFFFAOYSA-N
XLogP1.95
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.19
LogP ≤ 51.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

6-Propan-2-yl-3,4-dihydropyridine
CID 14979258
3aH-pyrrolo[2,3-c]pyridine
CID 20778925
5-(2-methylpropyl)-3H-pyrrole
CID 22094961
4,6-Dimethyl-3,4-dihydropyridine
CID 53738464
5-ethyl-3-ethyl-3H-pyrrole;tungsten
CID 57710493
3,5-diethyl-3H-pyrrole
CID 57710494
2-tert-butyl-7aH-pyrrolo[3,2-b]pyridine
CID 59457874
3,4,6-Trimethyl-3,4-dihydropyridine
CID 59701053
(3Z)-3-ethylidene-N-methylpyridin-4-imine
CID 68179744
(3S)-3,4,6-trimethyl-3,4-dihydropyridine
CID 68330621
3-Ethenyl-6-ethyl-3,4-dihydropyridine
CID 68343847
(3S)-3,6-dimethyl-3,4-dihydropyridine
CID 70325789

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-3aH-pyrrolo[2,3-c]pyridine?
The IUPAC name of 2-ethyl-3aH-pyrrolo[2,3-c]pyridine (CID 156793397) is 2-ethyl-3aH-pyrrolo[2,3-c]pyridine.
What is the SMILES notation for 2-ethyl-3aH-pyrrolo[2,3-c]pyridine?
The canonical SMILES for 2-ethyl-3aH-pyrrolo[2,3-c]pyridine is CCC1=CC2C=CN=CC2=N1.
What is the InChIKey of 2-ethyl-3aH-pyrrolo[2,3-c]pyridine?
The InChIKey is NOIUBSWAUDCGCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2/c1-2-8-5-7-3-4-10-6-9(7)11-8/h3-7H,2H2,1H3.
What are the key properties of 2-ethyl-3aH-pyrrolo[2,3-c]pyridine?
2-ethyl-3aH-pyrrolo[2,3-c]pyridine has a molecular weight of 146.19 g/mol, XLogP of 1.95, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-3aH-pyrrolo[2,3-c]pyridine is sourced from PubChem (CID 156793397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).