7-[4-(6-cyano-1H-indol-2-yl)phenyl]imidazo[1,2-a]pyridine-2-carbonitrile

C23H13N5 — CID 89445254

IUPAC7-[4-(6-cyano-1H-indol-2-yl)phenyl]imidazo[1,2-a]pyridine-2-carbonitrile
SMILESN#Cc1ccc2cc(-c3ccc(-c4ccn5cc(C#N)nc5c4)cc3)[nH]c2c1
InChIInChI=1S/C23H13N5/c24-12-15-1-2-19-10-22(27-21(19)9-15)17-5-3-16(4-6-17)18-7-8-28-14-20(13-25)26-23(28)11-18/h1-11,14,27H
InChIKeyRQPADXQQFDLUIA-UHFFFAOYSA-N
MW359.39 g/mol
LogP4.89
Rot. Bonds2

About 7-[4-(6-cyano-1H-indol-2-yl)phenyl]imidazo[1,2-a]pyridine-2-carbonitrile

7-[4-(6-cyano-1H-indol-2-yl)phenyl]imidazo[1,2-a]pyridine-2-carbonitrile (PubChem CID 89445254) has the molecular formula C23H13N5 and a molecular weight of 359.39 g/mol. Its IUPAC name is 7-[4-(6-cyano-1H-indol-2-yl)phenyl]imidazo[1,2-a]pyridine-2-carbonitrile.

Molecular Properties

Compound Name7-[4-(6-cyano-1H-indol-2-yl)phenyl]imidazo[1,2-a]pyridine-2-carbonitrile
PubChem CID89445254
Molecular FormulaC23H13N5
Molecular Weight359.39 g/mol
Exact Mass359.12
IUPAC Name7-[4-(6-cyano-1H-indol-2-yl)phenyl]imidazo[1,2-a]pyridine-2-carbonitrile
SMILESN#Cc1ccc2cc(-c3ccc(-c4ccn5cc(C#N)nc5c4)cc3)[nH]c2c1
InChIInChI=1S/C23H13N5/c24-12-15-1-2-19-10-22(27-21(19)9-15)17-5-3-16(4-6-17)18-7-8-28-14-20(13-25)26-23(28)11-18/h1-11,14,27H
InChIKeyRQPADXQQFDLUIA-UHFFFAOYSA-N
XLogP4.89
TPSA80.67 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.39
LogP ≤ 54.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7-[4-(6-cyano-1H-indol-2-yl)phenyl]imidazo[1,2-a]pyridine-2-carbonitrile?
The IUPAC name of 7-[4-(6-cyano-1H-indol-2-yl)phenyl]imidazo[1,2-a]pyridine-2-carbonitrile (CID 89445254) is 7-[4-(6-cyano-1H-indol-2-yl)phenyl]imidazo[1,2-a]pyridine-2-carbonitrile.
What is the SMILES notation for 7-[4-(6-cyano-1H-indol-2-yl)phenyl]imidazo[1,2-a]pyridine-2-carbonitrile?
The canonical SMILES for 7-[4-(6-cyano-1H-indol-2-yl)phenyl]imidazo[1,2-a]pyridine-2-carbonitrile is N#Cc1ccc2cc(-c3ccc(-c4ccn5cc(C#N)nc5c4)cc3)[nH]c2c1.
What is the InChIKey of 7-[4-(6-cyano-1H-indol-2-yl)phenyl]imidazo[1,2-a]pyridine-2-carbonitrile?
The InChIKey is RQPADXQQFDLUIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H13N5/c24-12-15-1-2-19-10-22(27-21(19)9-15)17-5-3-16(4-6-17)18-7-8-28-14-20(13-25)26-23(28)11-18/h1-11,14,27H.
What are the key properties of 7-[4-(6-cyano-1H-indol-2-yl)phenyl]imidazo[1,2-a]pyridine-2-carbonitrile?
7-[4-(6-cyano-1H-indol-2-yl)phenyl]imidazo[1,2-a]pyridine-2-carbonitrile has a molecular weight of 359.39 g/mol, XLogP of 4.89, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[4-(6-cyano-1H-indol-2-yl)phenyl]imidazo[1,2-a]pyridine-2-carbonitrile is sourced from PubChem (CID 89445254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).