N-[(3-imidazo[1,2-a]pyridin-3-ylphenyl)methyl]-5H-chromeno[3,4-c]pyridine-8-carboxamide

C27H20N4O2 — CID 121363513

IUPACN-[(3-imidazo[1,2-a]pyridin-3-ylphenyl)methyl]-5H-chromeno[3,4-c]pyridine-8-carboxamide
SMILESO=C(NCc1cccc(-c2cnc3ccccn23)c1)c1ccc2c(c1)OCc1cnccc1-2
InChIInChI=1S/C27H20N4O2/c32-27(20-7-8-23-22-9-10-28-15-21(22)17-33-25(23)13-20)30-14-18-4-3-5-19(12-18)24-16-29-26-6-1-2-11-31(24)26/h1-13,15-16H,14,17H2,(H,30,32)
InChIKeyULEQHPSKWADKFY-UHFFFAOYSA-N
MW432.48 g/mol
LogP4.89
Rot. Bonds4

About N-[(3-imidazo[1,2-a]pyridin-3-ylphenyl)methyl]-5H-chromeno[3,4-c]pyridine-8-carboxamide

N-[(3-imidazo[1,2-a]pyridin-3-ylphenyl)methyl]-5H-chromeno[3,4-c]pyridine-8-carboxamide (PubChem CID 121363513) has the molecular formula C27H20N4O2 and a molecular weight of 432.48 g/mol. Its IUPAC name is N-[(3-imidazo[1,2-a]pyridin-3-ylphenyl)methyl]-5H-chromeno[3,4-c]pyridine-8-carboxamide.

Molecular Properties

Compound NameN-[(3-imidazo[1,2-a]pyridin-3-ylphenyl)methyl]-5H-chromeno[3,4-c]pyridine-8-carboxamide
PubChem CID121363513
Molecular FormulaC27H20N4O2
Molecular Weight432.48 g/mol
Exact Mass432.16
IUPAC NameN-[(3-imidazo[1,2-a]pyridin-3-ylphenyl)methyl]-5H-chromeno[3,4-c]pyridine-8-carboxamide
SMILESO=C(NCc1cccc(-c2cnc3ccccn23)c1)c1ccc2c(c1)OCc1cnccc1-2
InChIInChI=1S/C27H20N4O2/c32-27(20-7-8-23-22-9-10-28-15-21(22)17-33-25(23)13-20)30-14-18-4-3-5-19(12-18)24-16-29-26-6-1-2-11-31(24)26/h1-13,15-16H,14,17H2,(H,30,32)
InChIKeyULEQHPSKWADKFY-UHFFFAOYSA-N
XLogP4.89
TPSA68.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500432.48
LogP ≤ 54.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[(3-imidazo[1,2-a]pyridin-3-ylphenyl)methyl]-5H-chromeno[3,4-c]pyridine-8-carboxamide?
The IUPAC name of N-[(3-imidazo[1,2-a]pyridin-3-ylphenyl)methyl]-5H-chromeno[3,4-c]pyridine-8-carboxamide (CID 121363513) is N-[(3-imidazo[1,2-a]pyridin-3-ylphenyl)methyl]-5H-chromeno[3,4-c]pyridine-8-carboxamide.
What is the SMILES notation for N-[(3-imidazo[1,2-a]pyridin-3-ylphenyl)methyl]-5H-chromeno[3,4-c]pyridine-8-carboxamide?
The canonical SMILES for N-[(3-imidazo[1,2-a]pyridin-3-ylphenyl)methyl]-5H-chromeno[3,4-c]pyridine-8-carboxamide is O=C(NCc1cccc(-c2cnc3ccccn23)c1)c1ccc2c(c1)OCc1cnccc1-2.
What is the InChIKey of N-[(3-imidazo[1,2-a]pyridin-3-ylphenyl)methyl]-5H-chromeno[3,4-c]pyridine-8-carboxamide?
The InChIKey is ULEQHPSKWADKFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H20N4O2/c32-27(20-7-8-23-22-9-10-28-15-21(22)17-33-25(23)13-20)30-14-18-4-3-5-19(12-18)24-16-29-26-6-1-2-11-31(24)26/h1-13,15-16H,14,17H2,(H,30,32).
What are the key properties of N-[(3-imidazo[1,2-a]pyridin-3-ylphenyl)methyl]-5H-chromeno[3,4-c]pyridine-8-carboxamide?
N-[(3-imidazo[1,2-a]pyridin-3-ylphenyl)methyl]-5H-chromeno[3,4-c]pyridine-8-carboxamide has a molecular weight of 432.48 g/mol, XLogP of 4.89, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-imidazo[1,2-a]pyridin-3-ylphenyl)methyl]-5H-chromeno[3,4-c]pyridine-8-carboxamide is sourced from PubChem (CID 121363513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).