2-ethoxy-N-(5-imidazo[1,2-a]pyrimidin-2-yl-2-methylphenyl)benzamide

C22H20N4O2 — CID 7080210

IUPAC2-ethoxy-N-(5-imidazo[1,2-a]pyrimidin-2-yl-2-methylphenyl)benzamide
SMILESCCOc1ccccc1C(=O)Nc1cc(-c2cn3cccnc3n2)ccc1C
InChIInChI=1S/C22H20N4O2/c1-3-28-20-8-5-4-7-17(20)21(27)24-18-13-16(10-9-15(18)2)19-14-26-12-6-11-23-22(26)25-19/h4-14H,3H2,1-2H3,(H,24,27)
InChIKeyNMODLNHGVFEMDI-UHFFFAOYSA-N
MW372.43 g/mol
LogP4.36
Rot. Bonds5

About 2-ethoxy-N-(5-imidazo[1,2-a]pyrimidin-2-yl-2-methylphenyl)benzamide

2-ethoxy-N-(5-imidazo[1,2-a]pyrimidin-2-yl-2-methylphenyl)benzamide (PubChem CID 7080210) has the molecular formula C22H20N4O2 and a molecular weight of 372.43 g/mol. Its IUPAC name is 2-ethoxy-N-(5-imidazo[1,2-a]pyrimidin-2-yl-2-methylphenyl)benzamide.

Molecular Properties

Compound Name2-ethoxy-N-(5-imidazo[1,2-a]pyrimidin-2-yl-2-methylphenyl)benzamide
PubChem CID7080210
Molecular FormulaC22H20N4O2
Molecular Weight372.43 g/mol
Exact Mass372.16
IUPAC Name2-ethoxy-N-(5-imidazo[1,2-a]pyrimidin-2-yl-2-methylphenyl)benzamide
SMILESCCOc1ccccc1C(=O)Nc1cc(-c2cn3cccnc3n2)ccc1C
InChIInChI=1S/C22H20N4O2/c1-3-28-20-8-5-4-7-17(20)21(27)24-18-13-16(10-9-15(18)2)19-14-26-12-6-11-23-22(26)25-19/h4-14H,3H2,1-2H3,(H,24,27)
InChIKeyNMODLNHGVFEMDI-UHFFFAOYSA-N
XLogP4.36
TPSA68.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.43
LogP ≤ 54.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-(5-imidazo[1,2-a]pyrimidin-2-yl-2-methylphenyl)benzamide?
The IUPAC name of 2-ethoxy-N-(5-imidazo[1,2-a]pyrimidin-2-yl-2-methylphenyl)benzamide (CID 7080210) is 2-ethoxy-N-(5-imidazo[1,2-a]pyrimidin-2-yl-2-methylphenyl)benzamide.
What is the SMILES notation for 2-ethoxy-N-(5-imidazo[1,2-a]pyrimidin-2-yl-2-methylphenyl)benzamide?
The canonical SMILES for 2-ethoxy-N-(5-imidazo[1,2-a]pyrimidin-2-yl-2-methylphenyl)benzamide is CCOc1ccccc1C(=O)Nc1cc(-c2cn3cccnc3n2)ccc1C.
What is the InChIKey of 2-ethoxy-N-(5-imidazo[1,2-a]pyrimidin-2-yl-2-methylphenyl)benzamide?
The InChIKey is NMODLNHGVFEMDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N4O2/c1-3-28-20-8-5-4-7-17(20)21(27)24-18-13-16(10-9-15(18)2)19-14-26-12-6-11-23-22(26)25-19/h4-14H,3H2,1-2H3,(H,24,27).
What are the key properties of 2-ethoxy-N-(5-imidazo[1,2-a]pyrimidin-2-yl-2-methylphenyl)benzamide?
2-ethoxy-N-(5-imidazo[1,2-a]pyrimidin-2-yl-2-methylphenyl)benzamide has a molecular weight of 372.43 g/mol, XLogP of 4.36, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-(5-imidazo[1,2-a]pyrimidin-2-yl-2-methylphenyl)benzamide is sourced from PubChem (CID 7080210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).