2-(4-chlorophenoxy)-2-methyl-N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]propanamide

C23H24ClN3O2 — CID 122282914

IUPAC2-(4-chlorophenoxy)-2-methyl-N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]propanamide
SMILESCC(C)(Oc1ccc(Cl)cc1)C(=O)Nc1ccccc1-c1cn2c(n1)CCCC2
InChIInChI=1S/C23H24ClN3O2/c1-23(2,29-17-12-10-16(24)11-13-17)22(28)26-19-8-4-3-7-18(19)20-15-27-14-6-5-9-21(27)25-20/h3-4,7-8,10-13,15H,5-6,9,14H2,1-2H3,(H,26,28)
InChIKeyLRISNUORLXTARK-UHFFFAOYSA-N
MW409.92 g/mol
LogP5.34
Rot. Bonds5

About 2-(4-chlorophenoxy)-2-methyl-N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]propanamide

2-(4-chlorophenoxy)-2-methyl-N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]propanamide (PubChem CID 122282914) has the molecular formula C23H24ClN3O2 and a molecular weight of 409.92 g/mol. Its IUPAC name is 2-(4-chlorophenoxy)-2-methyl-N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]propanamide.

Molecular Properties

Compound Name2-(4-chlorophenoxy)-2-methyl-N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]propanamide
PubChem CID122282914
Molecular FormulaC23H24ClN3O2
Molecular Weight409.92 g/mol
Exact Mass409.16
IUPAC Name2-(4-chlorophenoxy)-2-methyl-N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]propanamide
SMILESCC(C)(Oc1ccc(Cl)cc1)C(=O)Nc1ccccc1-c1cn2c(n1)CCCC2
InChIInChI=1S/C23H24ClN3O2/c1-23(2,29-17-12-10-16(24)11-13-17)22(28)26-19-8-4-3-7-18(19)20-15-27-14-6-5-9-21(27)25-20/h3-4,7-8,10-13,15H,5-6,9,14H2,1-2H3,(H,26,28)
InChIKeyLRISNUORLXTARK-UHFFFAOYSA-N
XLogP5.34
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500409.92
LogP ≤ 55.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenoxy)-2-methyl-N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]propanamide?
The IUPAC name of 2-(4-chlorophenoxy)-2-methyl-N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]propanamide (CID 122282914) is 2-(4-chlorophenoxy)-2-methyl-N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]propanamide.
What is the SMILES notation for 2-(4-chlorophenoxy)-2-methyl-N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]propanamide?
The canonical SMILES for 2-(4-chlorophenoxy)-2-methyl-N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]propanamide is CC(C)(Oc1ccc(Cl)cc1)C(=O)Nc1ccccc1-c1cn2c(n1)CCCC2.
What is the InChIKey of 2-(4-chlorophenoxy)-2-methyl-N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]propanamide?
The InChIKey is LRISNUORLXTARK-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24ClN3O2/c1-23(2,29-17-12-10-16(24)11-13-17)22(28)26-19-8-4-3-7-18(19)20-15-27-14-6-5-9-21(27)25-20/h3-4,7-8,10-13,15H,5-6,9,14H2,1-2H3,(H,26,28).
What are the key properties of 2-(4-chlorophenoxy)-2-methyl-N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]propanamide?
2-(4-chlorophenoxy)-2-methyl-N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]propanamide has a molecular weight of 409.92 g/mol, XLogP of 5.34, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenoxy)-2-methyl-N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]propanamide is sourced from PubChem (CID 122282914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).