1,3,4-tri(propan-2-yl)pyrrolo[3,2-c]pyridine

C16H24N2 — CID 71038115

IUPAC1,3,4-tri(propan-2-yl)pyrrolo[3,2-c]pyridine
SMILESCC(C)c1cn(C(C)C)c2ccnc(C(C)C)c12
InChIInChI=1S/C16H24N2/c1-10(2)13-9-18(12(5)6)14-7-8-17-16(11(3)4)15(13)14/h7-12H,1-6H3
InChIKeyGHFZVGFZGJRWRA-UHFFFAOYSA-N
MW244.38 g/mol
LogP4.86
Rot. Bonds3

About 1,3,4-tri(propan-2-yl)pyrrolo[3,2-c]pyridine

1,3,4-tri(propan-2-yl)pyrrolo[3,2-c]pyridine (PubChem CID 71038115) has the molecular formula C16H24N2 and a molecular weight of 244.38 g/mol. Its IUPAC name is 1,3,4-tri(propan-2-yl)pyrrolo[3,2-c]pyridine.

Molecular Properties

Compound Name1,3,4-tri(propan-2-yl)pyrrolo[3,2-c]pyridine
PubChem CID71038115
Molecular FormulaC16H24N2
Molecular Weight244.38 g/mol
Exact Mass244.19
IUPAC Name1,3,4-tri(propan-2-yl)pyrrolo[3,2-c]pyridine
SMILESCC(C)c1cn(C(C)C)c2ccnc(C(C)C)c12
InChIInChI=1S/C16H24N2/c1-10(2)13-9-18(12(5)6)14-7-8-17-16(11(3)4)15(13)14/h7-12H,1-6H3
InChIKeyGHFZVGFZGJRWRA-UHFFFAOYSA-N
XLogP4.86
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.38
LogP ≤ 54.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1,3,4-tri(propan-2-yl)pyrrolo[3,2-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 1,3,4-tri(propan-2-yl)pyrrolo[3,2-c]pyridine?
The IUPAC name of 1,3,4-tri(propan-2-yl)pyrrolo[3,2-c]pyridine (CID 71038115) is 1,3,4-tri(propan-2-yl)pyrrolo[3,2-c]pyridine.
What is the SMILES notation for 1,3,4-tri(propan-2-yl)pyrrolo[3,2-c]pyridine?
The canonical SMILES for 1,3,4-tri(propan-2-yl)pyrrolo[3,2-c]pyridine is CC(C)c1cn(C(C)C)c2ccnc(C(C)C)c12.
What is the InChIKey of 1,3,4-tri(propan-2-yl)pyrrolo[3,2-c]pyridine?
The InChIKey is GHFZVGFZGJRWRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2/c1-10(2)13-9-18(12(5)6)14-7-8-17-16(11(3)4)15(13)14/h7-12H,1-6H3.
What are the key properties of 1,3,4-tri(propan-2-yl)pyrrolo[3,2-c]pyridine?
1,3,4-tri(propan-2-yl)pyrrolo[3,2-c]pyridine has a molecular weight of 244.38 g/mol, XLogP of 4.86, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3,4-tri(propan-2-yl)pyrrolo[3,2-c]pyridine is sourced from PubChem (CID 71038115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).