N-[(4-methoxyphenyl)methyl]-6-quinolin-6-ylimidazo[1,2-a]pyridine-3-carboxamide

C25H20N4O2 — CID 164613436

IUPACN-[(4-methoxyphenyl)methyl]-6-quinolin-6-ylimidazo[1,2-a]pyridine-3-carboxamide
SMILESCOc1ccc(CNC(=O)c2cnc3ccc(-c4ccc5ncccc5c4)cn23)cc1
InChIInChI=1S/C25H20N4O2/c1-31-21-8-4-17(5-9-21)14-28-25(30)23-15-27-24-11-7-20(16-29(23)24)18-6-10-22-19(13-18)3-2-12-26-22/h2-13,15-16H,14H2,1H3,(H,28,30)
InChIKeyAAYFHKFUAWLHMY-UHFFFAOYSA-N
MW408.46 g/mol
LogP4.49
Rot. Bonds5

About N-[(4-methoxyphenyl)methyl]-6-quinolin-6-ylimidazo[1,2-a]pyridine-3-carboxamide

N-[(4-methoxyphenyl)methyl]-6-quinolin-6-ylimidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 164613436) has the molecular formula C25H20N4O2 and a molecular weight of 408.46 g/mol. Its IUPAC name is N-[(4-methoxyphenyl)methyl]-6-quinolin-6-ylimidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[(4-methoxyphenyl)methyl]-6-quinolin-6-ylimidazo[1,2-a]pyridine-3-carboxamide
PubChem CID164613436
Molecular FormulaC25H20N4O2
Molecular Weight408.46 g/mol
Exact Mass408.16
IUPAC NameN-[(4-methoxyphenyl)methyl]-6-quinolin-6-ylimidazo[1,2-a]pyridine-3-carboxamide
SMILESCOc1ccc(CNC(=O)c2cnc3ccc(-c4ccc5ncccc5c4)cn23)cc1
InChIInChI=1S/C25H20N4O2/c1-31-21-8-4-17(5-9-21)14-28-25(30)23-15-27-24-11-7-20(16-29(23)24)18-6-10-22-19(13-18)3-2-12-26-22/h2-13,15-16H,14H2,1H3,(H,28,30)
InChIKeyAAYFHKFUAWLHMY-UHFFFAOYSA-N
XLogP4.49
TPSA68.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500408.46
LogP ≤ 54.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

CID 68234908
CID 68234908
CID 155309155
CID 155309155
CID 4055067
CID 4055067
CID 675270
CID 675270
CID 16009052
CID 16009052
CID 11258617
CID 11258617
CID 44562307
CID 44562307
CID 44562309
CID 44562309
CID 44562310
CID 44562310
CID 44562312
CID 44562312
CID 44562314
CID 44562314
CID 44578686
CID 44578686

Frequently Asked Questions

What is the IUPAC name of N-[(4-methoxyphenyl)methyl]-6-quinolin-6-ylimidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of N-[(4-methoxyphenyl)methyl]-6-quinolin-6-ylimidazo[1,2-a]pyridine-3-carboxamide (CID 164613436) is N-[(4-methoxyphenyl)methyl]-6-quinolin-6-ylimidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for N-[(4-methoxyphenyl)methyl]-6-quinolin-6-ylimidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for N-[(4-methoxyphenyl)methyl]-6-quinolin-6-ylimidazo[1,2-a]pyridine-3-carboxamide is COc1ccc(CNC(=O)c2cnc3ccc(-c4ccc5ncccc5c4)cn23)cc1.
What is the InChIKey of N-[(4-methoxyphenyl)methyl]-6-quinolin-6-ylimidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is AAYFHKFUAWLHMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H20N4O2/c1-31-21-8-4-17(5-9-21)14-28-25(30)23-15-27-24-11-7-20(16-29(23)24)18-6-10-22-19(13-18)3-2-12-26-22/h2-13,15-16H,14H2,1H3,(H,28,30).
What are the key properties of N-[(4-methoxyphenyl)methyl]-6-quinolin-6-ylimidazo[1,2-a]pyridine-3-carboxamide?
N-[(4-methoxyphenyl)methyl]-6-quinolin-6-ylimidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 408.46 g/mol, XLogP of 4.49, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methoxyphenyl)methyl]-6-quinolin-6-ylimidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 164613436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).