N-[(3-methoxyphenyl)methyl]-N-methyl-7-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxamide

C20H19N5O2 — CID 67107581

IUPACN-[(3-methoxyphenyl)methyl]-N-methyl-7-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxamide
SMILESCOc1cccc(CN(C)C(=O)c2cnc3cc(-c4cn[nH]c4)ccn23)c1
InChIInChI=1S/C20H19N5O2/c1-24(13-14-4-3-5-17(8-14)27-2)20(26)18-12-21-19-9-15(6-7-25(18)19)16-10-22-23-11-16/h3-12H,13H2,1-2H3,(H,22,23)
InChIKeyRMGPUUQKQCVGCA-UHFFFAOYSA-N
MW361.41 g/mol
LogP3.01
Rot. Bonds5

About N-[(3-methoxyphenyl)methyl]-N-methyl-7-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxamide

N-[(3-methoxyphenyl)methyl]-N-methyl-7-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 67107581) has the molecular formula C20H19N5O2 and a molecular weight of 361.41 g/mol. Its IUPAC name is N-[(3-methoxyphenyl)methyl]-N-methyl-7-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[(3-methoxyphenyl)methyl]-N-methyl-7-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxamide
PubChem CID67107581
Molecular FormulaC20H19N5O2
Molecular Weight361.41 g/mol
Exact Mass361.15
IUPAC NameN-[(3-methoxyphenyl)methyl]-N-methyl-7-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxamide
SMILESCOc1cccc(CN(C)C(=O)c2cnc3cc(-c4cn[nH]c4)ccn23)c1
InChIInChI=1S/C20H19N5O2/c1-24(13-14-4-3-5-17(8-14)27-2)20(26)18-12-21-19-9-15(6-7-25(18)19)16-10-22-23-11-16/h3-12H,13H2,1-2H3,(H,22,23)
InChIKeyRMGPUUQKQCVGCA-UHFFFAOYSA-N
XLogP3.01
TPSA75.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.41
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[(3-methoxyphenyl)methyl]-N-methyl-7-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of N-[(3-methoxyphenyl)methyl]-N-methyl-7-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxamide (CID 67107581) is N-[(3-methoxyphenyl)methyl]-N-methyl-7-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for N-[(3-methoxyphenyl)methyl]-N-methyl-7-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for N-[(3-methoxyphenyl)methyl]-N-methyl-7-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxamide is COc1cccc(CN(C)C(=O)c2cnc3cc(-c4cn[nH]c4)ccn23)c1.
What is the InChIKey of N-[(3-methoxyphenyl)methyl]-N-methyl-7-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is RMGPUUQKQCVGCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N5O2/c1-24(13-14-4-3-5-17(8-14)27-2)20(26)18-12-21-19-9-15(6-7-25(18)19)16-10-22-23-11-16/h3-12H,13H2,1-2H3,(H,22,23).
What are the key properties of N-[(3-methoxyphenyl)methyl]-N-methyl-7-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxamide?
N-[(3-methoxyphenyl)methyl]-N-methyl-7-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 361.41 g/mol, XLogP of 3.01, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-methoxyphenyl)methyl]-N-methyl-7-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 67107581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).