2-(4-pyrrolidin-1-ylphenyl)-3H-pyrrolo[2,3-c]pyridine

C17H17N3 — CID 158254975

IUPAC2-(4-pyrrolidin-1-ylphenyl)-3H-pyrrolo[2,3-c]pyridine
SMILESc1cc2c(cn1)N=C(c1ccc(N3CCCC3)cc1)C2
InChIInChI=1S/C17H17N3/c1-2-10-20(9-1)15-5-3-13(4-6-15)16-11-14-7-8-18-12-17(14)19-16/h3-8,12H,1-2,9-11H2
InChIKeyGHECEPATSZRQNL-UHFFFAOYSA-N
MW263.34 g/mol
LogP3.36
Rot. Bonds2

About 2-(4-pyrrolidin-1-ylphenyl)-3H-pyrrolo[2,3-c]pyridine

2-(4-pyrrolidin-1-ylphenyl)-3H-pyrrolo[2,3-c]pyridine (PubChem CID 158254975) has the molecular formula C17H17N3 and a molecular weight of 263.34 g/mol. Its IUPAC name is 2-(4-pyrrolidin-1-ylphenyl)-3H-pyrrolo[2,3-c]pyridine.

Molecular Properties

Compound Name2-(4-pyrrolidin-1-ylphenyl)-3H-pyrrolo[2,3-c]pyridine
PubChem CID158254975
Molecular FormulaC17H17N3
Molecular Weight263.34 g/mol
Exact Mass263.14
IUPAC Name2-(4-pyrrolidin-1-ylphenyl)-3H-pyrrolo[2,3-c]pyridine
SMILESc1cc2c(cn1)N=C(c1ccc(N3CCCC3)cc1)C2
InChIInChI=1S/C17H17N3/c1-2-10-20(9-1)15-5-3-13(4-6-15)16-11-14-7-8-18-12-17(14)19-16/h3-8,12H,1-2,9-11H2
InChIKeyGHECEPATSZRQNL-UHFFFAOYSA-N
XLogP3.36
TPSA28.49 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 53.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(4-pyrrolidin-1-ylphenyl)-3H-pyrrolo[2,3-c]pyridine?
The IUPAC name of 2-(4-pyrrolidin-1-ylphenyl)-3H-pyrrolo[2,3-c]pyridine (CID 158254975) is 2-(4-pyrrolidin-1-ylphenyl)-3H-pyrrolo[2,3-c]pyridine.
What is the SMILES notation for 2-(4-pyrrolidin-1-ylphenyl)-3H-pyrrolo[2,3-c]pyridine?
The canonical SMILES for 2-(4-pyrrolidin-1-ylphenyl)-3H-pyrrolo[2,3-c]pyridine is c1cc2c(cn1)N=C(c1ccc(N3CCCC3)cc1)C2.
What is the InChIKey of 2-(4-pyrrolidin-1-ylphenyl)-3H-pyrrolo[2,3-c]pyridine?
The InChIKey is GHECEPATSZRQNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3/c1-2-10-20(9-1)15-5-3-13(4-6-15)16-11-14-7-8-18-12-17(14)19-16/h3-8,12H,1-2,9-11H2.
What are the key properties of 2-(4-pyrrolidin-1-ylphenyl)-3H-pyrrolo[2,3-c]pyridine?
2-(4-pyrrolidin-1-ylphenyl)-3H-pyrrolo[2,3-c]pyridine has a molecular weight of 263.34 g/mol, XLogP of 3.36, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-pyrrolidin-1-ylphenyl)-3H-pyrrolo[2,3-c]pyridine is sourced from PubChem (CID 158254975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).