2,3,4,5-tetramethyl-1H-pyrrolo[2,3-b]pyridine

C11H14N2 — CID 167207621

IUPAC2,3,4,5-tetramethyl-1H-pyrrolo[2,3-b]pyridine
SMILESCc1cnc2[nH]c(C)c(C)c2c1C
InChIInChI=1S/C11H14N2/c1-6-5-12-11-10(7(6)2)8(3)9(4)13-11/h5H,1-4H3,(H,12,13)
InChIKeyTURDOAQRULMLAB-UHFFFAOYSA-N
MW174.25 g/mol
LogP2.80
Rot. Bonds

About 2,3,4,5-tetramethyl-1H-pyrrolo[2,3-b]pyridine

2,3,4,5-tetramethyl-1H-pyrrolo[2,3-b]pyridine (PubChem CID 167207621) has the molecular formula C11H14N2 and a molecular weight of 174.25 g/mol. Its IUPAC name is 2,3,4,5-tetramethyl-1H-pyrrolo[2,3-b]pyridine.

Molecular Properties

Compound Name2,3,4,5-tetramethyl-1H-pyrrolo[2,3-b]pyridine
PubChem CID167207621
Molecular FormulaC11H14N2
Molecular Weight174.25 g/mol
Exact Mass174.12
IUPAC Name2,3,4,5-tetramethyl-1H-pyrrolo[2,3-b]pyridine
SMILESCc1cnc2[nH]c(C)c(C)c2c1C
InChIInChI=1S/C11H14N2/c1-6-5-12-11-10(7(6)2)8(3)9(4)13-11/h5H,1-4H3,(H,12,13)
InChIKeyTURDOAQRULMLAB-UHFFFAOYSA-N
XLogP2.80
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.25
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,3,4,5-tetramethyl-1H-pyrrolo[2,3-b]pyridine?
The IUPAC name of 2,3,4,5-tetramethyl-1H-pyrrolo[2,3-b]pyridine (CID 167207621) is 2,3,4,5-tetramethyl-1H-pyrrolo[2,3-b]pyridine.
What is the SMILES notation for 2,3,4,5-tetramethyl-1H-pyrrolo[2,3-b]pyridine?
The canonical SMILES for 2,3,4,5-tetramethyl-1H-pyrrolo[2,3-b]pyridine is Cc1cnc2[nH]c(C)c(C)c2c1C.
What is the InChIKey of 2,3,4,5-tetramethyl-1H-pyrrolo[2,3-b]pyridine?
The InChIKey is TURDOAQRULMLAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2/c1-6-5-12-11-10(7(6)2)8(3)9(4)13-11/h5H,1-4H3,(H,12,13).
What are the key properties of 2,3,4,5-tetramethyl-1H-pyrrolo[2,3-b]pyridine?
2,3,4,5-tetramethyl-1H-pyrrolo[2,3-b]pyridine has a molecular weight of 174.25 g/mol, XLogP of 2.80, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,4,5-tetramethyl-1H-pyrrolo[2,3-b]pyridine is sourced from PubChem (CID 167207621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).