6-(7-methoxy-6-pyridin-3-ylimidazo[1,2-a]pyridin-3-yl)-N-pyrrolidin-3-ylpyridin-2-amine

C22H22N6O — CID 134284346

IUPAC6-(7-methoxy-6-pyridin-3-ylimidazo[1,2-a]pyridin-3-yl)-N-pyrrolidin-3-ylpyridin-2-amine
SMILESCOc1cc2ncc(-c3cccc(NC4CCNC4)n3)n2cc1-c1cccnc1
InChIInChI=1S/C22H22N6O/c1-29-20-10-22-25-13-19(28(22)14-17(20)15-4-3-8-23-11-15)18-5-2-6-21(27-18)26-16-7-9-24-12-16/h2-6,8,10-11,13-14,16,24H,7,9,12H2,1H3,(H,26,27)
InChIKeyZQKNIPQNEVNCDY-UHFFFAOYSA-N
MW386.46 g/mol
LogP3.24
Rot. Bonds5

About 6-(7-methoxy-6-pyridin-3-ylimidazo[1,2-a]pyridin-3-yl)-N-pyrrolidin-3-ylpyridin-2-amine

6-(7-methoxy-6-pyridin-3-ylimidazo[1,2-a]pyridin-3-yl)-N-pyrrolidin-3-ylpyridin-2-amine (PubChem CID 134284346) has the molecular formula C22H22N6O and a molecular weight of 386.46 g/mol. Its IUPAC name is 6-(7-methoxy-6-pyridin-3-ylimidazo[1,2-a]pyridin-3-yl)-N-pyrrolidin-3-ylpyridin-2-amine.

Molecular Properties

Compound Name6-(7-methoxy-6-pyridin-3-ylimidazo[1,2-a]pyridin-3-yl)-N-pyrrolidin-3-ylpyridin-2-amine
PubChem CID134284346
Molecular FormulaC22H22N6O
Molecular Weight386.46 g/mol
Exact Mass386.19
IUPAC Name6-(7-methoxy-6-pyridin-3-ylimidazo[1,2-a]pyridin-3-yl)-N-pyrrolidin-3-ylpyridin-2-amine
SMILESCOc1cc2ncc(-c3cccc(NC4CCNC4)n3)n2cc1-c1cccnc1
InChIInChI=1S/C22H22N6O/c1-29-20-10-22-25-13-19(28(22)14-17(20)15-4-3-8-23-11-15)18-5-2-6-21(27-18)26-16-7-9-24-12-16/h2-6,8,10-11,13-14,16,24H,7,9,12H2,1H3,(H,26,27)
InChIKeyZQKNIPQNEVNCDY-UHFFFAOYSA-N
XLogP3.24
TPSA76.37 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.46
LogP ≤ 53.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 6-(7-methoxy-6-pyridin-3-ylimidazo[1,2-a]pyridin-3-yl)-N-pyrrolidin-3-ylpyridin-2-amine?
The IUPAC name of 6-(7-methoxy-6-pyridin-3-ylimidazo[1,2-a]pyridin-3-yl)-N-pyrrolidin-3-ylpyridin-2-amine (CID 134284346) is 6-(7-methoxy-6-pyridin-3-ylimidazo[1,2-a]pyridin-3-yl)-N-pyrrolidin-3-ylpyridin-2-amine.
What is the SMILES notation for 6-(7-methoxy-6-pyridin-3-ylimidazo[1,2-a]pyridin-3-yl)-N-pyrrolidin-3-ylpyridin-2-amine?
The canonical SMILES for 6-(7-methoxy-6-pyridin-3-ylimidazo[1,2-a]pyridin-3-yl)-N-pyrrolidin-3-ylpyridin-2-amine is COc1cc2ncc(-c3cccc(NC4CCNC4)n3)n2cc1-c1cccnc1.
What is the InChIKey of 6-(7-methoxy-6-pyridin-3-ylimidazo[1,2-a]pyridin-3-yl)-N-pyrrolidin-3-ylpyridin-2-amine?
The InChIKey is ZQKNIPQNEVNCDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N6O/c1-29-20-10-22-25-13-19(28(22)14-17(20)15-4-3-8-23-11-15)18-5-2-6-21(27-18)26-16-7-9-24-12-16/h2-6,8,10-11,13-14,16,24H,7,9,12H2,1H3,(H,26,27).
What are the key properties of 6-(7-methoxy-6-pyridin-3-ylimidazo[1,2-a]pyridin-3-yl)-N-pyrrolidin-3-ylpyridin-2-amine?
6-(7-methoxy-6-pyridin-3-ylimidazo[1,2-a]pyridin-3-yl)-N-pyrrolidin-3-ylpyridin-2-amine has a molecular weight of 386.46 g/mol, XLogP of 3.24, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(7-methoxy-6-pyridin-3-ylimidazo[1,2-a]pyridin-3-yl)-N-pyrrolidin-3-ylpyridin-2-amine is sourced from PubChem (CID 134284346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).