2-[2-imidazo[1,2-a]pyridin-5-yl-5-[(2-methylpropan-2-yl)oxy]phenoxy]-N-propan-2-ylacetamide

C22H27N3O3 — CID 118445693

IUPAC2-[2-imidazo[1,2-a]pyridin-5-yl-5-[(2-methylpropan-2-yl)oxy]phenoxy]-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)COc1cc(OC(C)(C)C)ccc1-c1cccc2nccn12
InChIInChI=1S/C22H27N3O3/c1-15(2)24-21(26)14-27-19-13-16(28-22(3,4)5)9-10-17(19)18-7-6-8-20-23-11-12-25(18)20/h6-13,15H,14H2,1-5H3,(H,24,26)
InChIKeyLEHNTTLEPWDWAK-UHFFFAOYSA-N
MW381.48 g/mol
LogP4.08
Rot. Bonds6

About 2-[2-imidazo[1,2-a]pyridin-5-yl-5-[(2-methylpropan-2-yl)oxy]phenoxy]-N-propan-2-ylacetamide

2-[2-imidazo[1,2-a]pyridin-5-yl-5-[(2-methylpropan-2-yl)oxy]phenoxy]-N-propan-2-ylacetamide (PubChem CID 118445693) has the molecular formula C22H27N3O3 and a molecular weight of 381.48 g/mol. Its IUPAC name is 2-[2-imidazo[1,2-a]pyridin-5-yl-5-[(2-methylpropan-2-yl)oxy]phenoxy]-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-[2-imidazo[1,2-a]pyridin-5-yl-5-[(2-methylpropan-2-yl)oxy]phenoxy]-N-propan-2-ylacetamide
PubChem CID118445693
Molecular FormulaC22H27N3O3
Molecular Weight381.48 g/mol
Exact Mass381.21
IUPAC Name2-[2-imidazo[1,2-a]pyridin-5-yl-5-[(2-methylpropan-2-yl)oxy]phenoxy]-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)COc1cc(OC(C)(C)C)ccc1-c1cccc2nccn12
InChIInChI=1S/C22H27N3O3/c1-15(2)24-21(26)14-27-19-13-16(28-22(3,4)5)9-10-17(19)18-7-6-8-20-23-11-12-25(18)20/h6-13,15H,14H2,1-5H3,(H,24,26)
InChIKeyLEHNTTLEPWDWAK-UHFFFAOYSA-N
XLogP4.08
TPSA64.86 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.48
LogP ≤ 54.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[2-imidazo[1,2-a]pyridin-5-yl-5-[(2-methylpropan-2-yl)oxy]phenoxy]-N-propan-2-ylacetamide?
The IUPAC name of 2-[2-imidazo[1,2-a]pyridin-5-yl-5-[(2-methylpropan-2-yl)oxy]phenoxy]-N-propan-2-ylacetamide (CID 118445693) is 2-[2-imidazo[1,2-a]pyridin-5-yl-5-[(2-methylpropan-2-yl)oxy]phenoxy]-N-propan-2-ylacetamide.
What is the SMILES notation for 2-[2-imidazo[1,2-a]pyridin-5-yl-5-[(2-methylpropan-2-yl)oxy]phenoxy]-N-propan-2-ylacetamide?
The canonical SMILES for 2-[2-imidazo[1,2-a]pyridin-5-yl-5-[(2-methylpropan-2-yl)oxy]phenoxy]-N-propan-2-ylacetamide is CC(C)NC(=O)COc1cc(OC(C)(C)C)ccc1-c1cccc2nccn12.
What is the InChIKey of 2-[2-imidazo[1,2-a]pyridin-5-yl-5-[(2-methylpropan-2-yl)oxy]phenoxy]-N-propan-2-ylacetamide?
The InChIKey is LEHNTTLEPWDWAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H27N3O3/c1-15(2)24-21(26)14-27-19-13-16(28-22(3,4)5)9-10-17(19)18-7-6-8-20-23-11-12-25(18)20/h6-13,15H,14H2,1-5H3,(H,24,26).
What are the key properties of 2-[2-imidazo[1,2-a]pyridin-5-yl-5-[(2-methylpropan-2-yl)oxy]phenoxy]-N-propan-2-ylacetamide?
2-[2-imidazo[1,2-a]pyridin-5-yl-5-[(2-methylpropan-2-yl)oxy]phenoxy]-N-propan-2-ylacetamide has a molecular weight of 381.48 g/mol, XLogP of 4.08, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-imidazo[1,2-a]pyridin-5-yl-5-[(2-methylpropan-2-yl)oxy]phenoxy]-N-propan-2-ylacetamide is sourced from PubChem (CID 118445693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).