3-aminoimidazo[1,2-a]pyridine-7,8-dicarbonitrile

C9H5N5 — CID 130065666

IUPAC3-aminoimidazo[1,2-a]pyridine-7,8-dicarbonitrile
SMILESN#Cc1ccn2c(N)cnc2c1C#N
InChIInChI=1S/C9H5N5/c10-3-6-1-2-14-8(12)5-13-9(14)7(6)4-11/h1-2,5H,12H2
InChIKeyRQEKACOMOAKGER-UHFFFAOYSA-N
MW183.17 g/mol
LogP0.66
Rot. Bonds

About 3-aminoimidazo[1,2-a]pyridine-7,8-dicarbonitrile

3-aminoimidazo[1,2-a]pyridine-7,8-dicarbonitrile (PubChem CID 130065666) has the molecular formula C9H5N5 and a molecular weight of 183.17 g/mol. Its IUPAC name is 3-aminoimidazo[1,2-a]pyridine-7,8-dicarbonitrile.

Molecular Properties

Compound Name3-aminoimidazo[1,2-a]pyridine-7,8-dicarbonitrile
PubChem CID130065666
Molecular FormulaC9H5N5
Molecular Weight183.17 g/mol
Exact Mass183.05
IUPAC Name3-aminoimidazo[1,2-a]pyridine-7,8-dicarbonitrile
SMILESN#Cc1ccn2c(N)cnc2c1C#N
InChIInChI=1S/C9H5N5/c10-3-6-1-2-14-8(12)5-13-9(14)7(6)4-11/h1-2,5H,12H2
InChIKeyRQEKACOMOAKGER-UHFFFAOYSA-N
XLogP0.66
TPSA90.90 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.17
LogP ≤ 50.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

8-bromo-7-chloroimidazo[1,2-a]pyridin-3-amine
CID 130065569
8-ethyl-7-fluoroimidazo[1,2-a]pyridin-3-amine
CID 130065514
3-aminoimidazo[1,2-a]pyrimidine-6-carbonitrile
CID 82415698
9-hydroxy-4-oxopyrido[1,2-a]pyrimidine-3-carbonitrile
CID 15136156
4-(8-chloroimidazo[1,2-a]pyridin-3-yl)pyrimidine-5-carbonitrile
CID 141139626
8-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-amine
CID 23316949
5,7-dimethylimidazo[1,2-c]pyrimidine-8-carbonitrile
CID 177024639
3-amino-5-ethylimidazo[1,2-a]pyridine-6-carbonitrile
CID 130065485
8-bromoimidazo[1,2-a]pyridine-3-carbonitrile
CID 126573761
3-(3-aminoimidazo[1,2-a]pyrimidin-6-yl)benzonitrile
CID 82389497
7-amino-5-phenylpyrazolo[1,5-a]pyrimidine-3,6-dicarbonitrile
CID 14950768
5-amino-1-[6-(5-amino-4-cyanopyrazol-1-yl)pyrimidin-4-yl]pyrazole-4-carbonitrile
CID 70646361

Frequently Asked Questions

What is the IUPAC name of 3-aminoimidazo[1,2-a]pyridine-7,8-dicarbonitrile?
The IUPAC name of 3-aminoimidazo[1,2-a]pyridine-7,8-dicarbonitrile (CID 130065666) is 3-aminoimidazo[1,2-a]pyridine-7,8-dicarbonitrile.
What is the SMILES notation for 3-aminoimidazo[1,2-a]pyridine-7,8-dicarbonitrile?
The canonical SMILES for 3-aminoimidazo[1,2-a]pyridine-7,8-dicarbonitrile is N#Cc1ccn2c(N)cnc2c1C#N.
What is the InChIKey of 3-aminoimidazo[1,2-a]pyridine-7,8-dicarbonitrile?
The InChIKey is RQEKACOMOAKGER-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H5N5/c10-3-6-1-2-14-8(12)5-13-9(14)7(6)4-11/h1-2,5H,12H2.
What are the key properties of 3-aminoimidazo[1,2-a]pyridine-7,8-dicarbonitrile?
3-aminoimidazo[1,2-a]pyridine-7,8-dicarbonitrile has a molecular weight of 183.17 g/mol, XLogP of 0.66, 0 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-aminoimidazo[1,2-a]pyridine-7,8-dicarbonitrile is sourced from PubChem (CID 130065666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).