2,5,6,7-tetramethyl-3-propan-2-yl-1H-pyrrolo[3,2-b]pyridine

C14H20N2 — CID 58026058

IUPAC2,5,6,7-tetramethyl-3-propan-2-yl-1H-pyrrolo[3,2-b]pyridine
SMILESCc1nc2c(C(C)C)c(C)[nH]c2c(C)c1C
InChIInChI=1S/C14H20N2/c1-7(2)12-11(6)16-13-9(4)8(3)10(5)15-14(12)13/h7,16H,1-6H3
InChIKeyHCNBKELVMRKLAO-UHFFFAOYSA-N
MW216.33 g/mol
LogP3.92
Rot. Bonds1

About 2,5,6,7-tetramethyl-3-propan-2-yl-1H-pyrrolo[3,2-b]pyridine

2,5,6,7-tetramethyl-3-propan-2-yl-1H-pyrrolo[3,2-b]pyridine (PubChem CID 58026058) has the molecular formula C14H20N2 and a molecular weight of 216.33 g/mol. Its IUPAC name is 2,5,6,7-tetramethyl-3-propan-2-yl-1H-pyrrolo[3,2-b]pyridine.

Molecular Properties

Compound Name2,5,6,7-tetramethyl-3-propan-2-yl-1H-pyrrolo[3,2-b]pyridine
PubChem CID58026058
Molecular FormulaC14H20N2
Molecular Weight216.33 g/mol
Exact Mass216.16
IUPAC Name2,5,6,7-tetramethyl-3-propan-2-yl-1H-pyrrolo[3,2-b]pyridine
SMILESCc1nc2c(C(C)C)c(C)[nH]c2c(C)c1C
InChIInChI=1S/C14H20N2/c1-7(2)12-11(6)16-13-9(4)8(3)10(5)15-14(12)13/h7,16H,1-6H3
InChIKeyHCNBKELVMRKLAO-UHFFFAOYSA-N
XLogP3.92
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.33
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,5,6,7-tetramethyl-3-propan-2-yl-1H-pyrrolo[3,2-b]pyridine?
The IUPAC name of 2,5,6,7-tetramethyl-3-propan-2-yl-1H-pyrrolo[3,2-b]pyridine (CID 58026058) is 2,5,6,7-tetramethyl-3-propan-2-yl-1H-pyrrolo[3,2-b]pyridine.
What is the SMILES notation for 2,5,6,7-tetramethyl-3-propan-2-yl-1H-pyrrolo[3,2-b]pyridine?
The canonical SMILES for 2,5,6,7-tetramethyl-3-propan-2-yl-1H-pyrrolo[3,2-b]pyridine is Cc1nc2c(C(C)C)c(C)[nH]c2c(C)c1C.
What is the InChIKey of 2,5,6,7-tetramethyl-3-propan-2-yl-1H-pyrrolo[3,2-b]pyridine?
The InChIKey is HCNBKELVMRKLAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2/c1-7(2)12-11(6)16-13-9(4)8(3)10(5)15-14(12)13/h7,16H,1-6H3.
What are the key properties of 2,5,6,7-tetramethyl-3-propan-2-yl-1H-pyrrolo[3,2-b]pyridine?
2,5,6,7-tetramethyl-3-propan-2-yl-1H-pyrrolo[3,2-b]pyridine has a molecular weight of 216.33 g/mol, XLogP of 3.92, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5,6,7-tetramethyl-3-propan-2-yl-1H-pyrrolo[3,2-b]pyridine is sourced from PubChem (CID 58026058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).