6-tert-butyl-2-ethyl-1-methyl-5,7-dihydro-4H-pyrrolo[2,3-c]pyridine

C14H24N2 — CID 175569331

IUPAC6-tert-butyl-2-ethyl-1-methyl-5,7-dihydro-4H-pyrrolo[2,3-c]pyridine
SMILESCCc1cc2c(n1C)CN(C(C)(C)C)CC2
InChIInChI=1S/C14H24N2/c1-6-12-9-11-7-8-16(14(2,3)4)10-13(11)15(12)5/h9H,6-8,10H2,1-5H3
InChIKeyCMDJEKKRFHOTKM-UHFFFAOYSA-N
MW220.36 g/mol
LogP2.74
Rot. Bonds1

About 6-tert-butyl-2-ethyl-1-methyl-5,7-dihydro-4H-pyrrolo[2,3-c]pyridine

6-tert-butyl-2-ethyl-1-methyl-5,7-dihydro-4H-pyrrolo[2,3-c]pyridine (PubChem CID 175569331) has the molecular formula C14H24N2 and a molecular weight of 220.36 g/mol. Its IUPAC name is 6-tert-butyl-2-ethyl-1-methyl-5,7-dihydro-4H-pyrrolo[2,3-c]pyridine.

Molecular Properties

Compound Name6-tert-butyl-2-ethyl-1-methyl-5,7-dihydro-4H-pyrrolo[2,3-c]pyridine
PubChem CID175569331
Molecular FormulaC14H24N2
Molecular Weight220.36 g/mol
Exact Mass220.19
IUPAC Name6-tert-butyl-2-ethyl-1-methyl-5,7-dihydro-4H-pyrrolo[2,3-c]pyridine
SMILESCCc1cc2c(n1C)CN(C(C)(C)C)CC2
InChIInChI=1S/C14H24N2/c1-6-12-9-11-7-8-16(14(2,3)4)10-13(11)15(12)5/h9H,6-8,10H2,1-5H3
InChIKeyCMDJEKKRFHOTKM-UHFFFAOYSA-N
XLogP2.74
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 52.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 6-tert-butyl-2-ethyl-1-methyl-5,7-dihydro-4H-pyrrolo[2,3-c]pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-tert-butyl-2-ethyl-1-methyl-5,7-dihydro-4H-pyrrolo[2,3-c]pyridine?
The IUPAC name of 6-tert-butyl-2-ethyl-1-methyl-5,7-dihydro-4H-pyrrolo[2,3-c]pyridine (CID 175569331) is 6-tert-butyl-2-ethyl-1-methyl-5,7-dihydro-4H-pyrrolo[2,3-c]pyridine.
What is the SMILES notation for 6-tert-butyl-2-ethyl-1-methyl-5,7-dihydro-4H-pyrrolo[2,3-c]pyridine?
The canonical SMILES for 6-tert-butyl-2-ethyl-1-methyl-5,7-dihydro-4H-pyrrolo[2,3-c]pyridine is CCc1cc2c(n1C)CN(C(C)(C)C)CC2.
What is the InChIKey of 6-tert-butyl-2-ethyl-1-methyl-5,7-dihydro-4H-pyrrolo[2,3-c]pyridine?
The InChIKey is CMDJEKKRFHOTKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2/c1-6-12-9-11-7-8-16(14(2,3)4)10-13(11)15(12)5/h9H,6-8,10H2,1-5H3.
What are the key properties of 6-tert-butyl-2-ethyl-1-methyl-5,7-dihydro-4H-pyrrolo[2,3-c]pyridine?
6-tert-butyl-2-ethyl-1-methyl-5,7-dihydro-4H-pyrrolo[2,3-c]pyridine has a molecular weight of 220.36 g/mol, XLogP of 2.74, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-tert-butyl-2-ethyl-1-methyl-5,7-dihydro-4H-pyrrolo[2,3-c]pyridine is sourced from PubChem (CID 175569331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).