2-ethoxy-N-[3-(3-methylimidazo[1,2-a]pyrimidin-2-yl)phenyl]benzamide

C22H20N4O2 — CID 7080312

IUPAC2-ethoxy-N-[3-(3-methylimidazo[1,2-a]pyrimidin-2-yl)phenyl]benzamide
SMILESCCOc1ccccc1C(=O)Nc1cccc(-c2nc3ncccn3c2C)c1
InChIInChI=1S/C22H20N4O2/c1-3-28-19-11-5-4-10-18(19)21(27)24-17-9-6-8-16(14-17)20-15(2)26-13-7-12-23-22(26)25-20/h4-14H,3H2,1-2H3,(H,24,27)
InChIKeyOCPFPYJVXUSXGP-UHFFFAOYSA-N
MW372.43 g/mol
LogP4.36
Rot. Bonds5

About 2-ethoxy-N-[3-(3-methylimidazo[1,2-a]pyrimidin-2-yl)phenyl]benzamide

2-ethoxy-N-[3-(3-methylimidazo[1,2-a]pyrimidin-2-yl)phenyl]benzamide (PubChem CID 7080312) has the molecular formula C22H20N4O2 and a molecular weight of 372.43 g/mol. Its IUPAC name is 2-ethoxy-N-[3-(3-methylimidazo[1,2-a]pyrimidin-2-yl)phenyl]benzamide.

Molecular Properties

Compound Name2-ethoxy-N-[3-(3-methylimidazo[1,2-a]pyrimidin-2-yl)phenyl]benzamide
PubChem CID7080312
Molecular FormulaC22H20N4O2
Molecular Weight372.43 g/mol
Exact Mass372.16
IUPAC Name2-ethoxy-N-[3-(3-methylimidazo[1,2-a]pyrimidin-2-yl)phenyl]benzamide
SMILESCCOc1ccccc1C(=O)Nc1cccc(-c2nc3ncccn3c2C)c1
InChIInChI=1S/C22H20N4O2/c1-3-28-19-11-5-4-10-18(19)21(27)24-17-9-6-8-16(14-17)20-15(2)26-13-7-12-23-22(26)25-20/h4-14H,3H2,1-2H3,(H,24,27)
InChIKeyOCPFPYJVXUSXGP-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-[3-(3-methylimidazo[1,2-a]pyrimidin-2-yl)phenyl]benzamide?
The IUPAC name of 2-ethoxy-N-[3-(3-methylimidazo[1,2-a]pyrimidin-2-yl)phenyl]benzamide (CID 7080312) is 2-ethoxy-N-[3-(3-methylimidazo[1,2-a]pyrimidin-2-yl)phenyl]benzamide.
What is the SMILES notation for 2-ethoxy-N-[3-(3-methylimidazo[1,2-a]pyrimidin-2-yl)phenyl]benzamide?
The canonical SMILES for 2-ethoxy-N-[3-(3-methylimidazo[1,2-a]pyrimidin-2-yl)phenyl]benzamide is CCOc1ccccc1C(=O)Nc1cccc(-c2nc3ncccn3c2C)c1.
What is the InChIKey of 2-ethoxy-N-[3-(3-methylimidazo[1,2-a]pyrimidin-2-yl)phenyl]benzamide?
The InChIKey is OCPFPYJVXUSXGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N4O2/c1-3-28-19-11-5-4-10-18(19)21(27)24-17-9-6-8-16(14-17)20-15(2)26-13-7-12-23-22(26)25-20/h4-14H,3H2,1-2H3,(H,24,27).
What are the key properties of 2-ethoxy-N-[3-(3-methylimidazo[1,2-a]pyrimidin-2-yl)phenyl]benzamide?
2-ethoxy-N-[3-(3-methylimidazo[1,2-a]pyrimidin-2-yl)phenyl]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-[3-(3-methylimidazo[1,2-a]pyrimidin-2-yl)phenyl]benzamide is sourced from PubChem (CID 7080312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).