2-(6-bromo-8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-N,N-dipropylacetamide

C22H26BrN3O — CID 10574530

IUPAC2-(6-bromo-8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-N,N-dipropylacetamide
SMILESCCCN(CCC)C(=O)Cc1c(-c2ccccc2)nc2c(C)cc(Br)cn12
InChIInChI=1S/C22H26BrN3O/c1-4-11-25(12-5-2)20(27)14-19-21(17-9-7-6-8-10-17)24-22-16(3)13-18(23)15-26(19)22/h6-10,13,15H,4-5,11-12,14H2,1-3H3
InChIKeyPJTBKEKZQLJZTM-UHFFFAOYSA-N
MW428.37 g/mol
LogP5.26
Rot. Bonds7

About 2-(6-bromo-8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-N,N-dipropylacetamide

2-(6-bromo-8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-N,N-dipropylacetamide (PubChem CID 10574530) has the molecular formula C22H26BrN3O and a molecular weight of 428.37 g/mol. Its IUPAC name is 2-(6-bromo-8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-N,N-dipropylacetamide.

Molecular Properties

Compound Name2-(6-bromo-8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-N,N-dipropylacetamide
PubChem CID10574530
Molecular FormulaC22H26BrN3O
Molecular Weight428.37 g/mol
Exact Mass427.13
IUPAC Name2-(6-bromo-8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-N,N-dipropylacetamide
SMILESCCCN(CCC)C(=O)Cc1c(-c2ccccc2)nc2c(C)cc(Br)cn12
InChIInChI=1S/C22H26BrN3O/c1-4-11-25(12-5-2)20(27)14-19-21(17-9-7-6-8-10-17)24-22-16(3)13-18(23)15-26(19)22/h6-10,13,15H,4-5,11-12,14H2,1-3H3
InChIKeyPJTBKEKZQLJZTM-UHFFFAOYSA-N
XLogP5.26
TPSA37.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500428.37
LogP ≤ 55.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(6-bromo-8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-N,N-dipropylacetamide?
The IUPAC name of 2-(6-bromo-8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-N,N-dipropylacetamide (CID 10574530) is 2-(6-bromo-8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-N,N-dipropylacetamide.
What is the SMILES notation for 2-(6-bromo-8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-N,N-dipropylacetamide?
The canonical SMILES for 2-(6-bromo-8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-N,N-dipropylacetamide is CCCN(CCC)C(=O)Cc1c(-c2ccccc2)nc2c(C)cc(Br)cn12.
What is the InChIKey of 2-(6-bromo-8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-N,N-dipropylacetamide?
The InChIKey is PJTBKEKZQLJZTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26BrN3O/c1-4-11-25(12-5-2)20(27)14-19-21(17-9-7-6-8-10-17)24-22-16(3)13-18(23)15-26(19)22/h6-10,13,15H,4-5,11-12,14H2,1-3H3.
What are the key properties of 2-(6-bromo-8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-N,N-dipropylacetamide?
2-(6-bromo-8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-N,N-dipropylacetamide has a molecular weight of 428.37 g/mol, XLogP of 5.26, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-bromo-8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-N,N-dipropylacetamide is sourced from PubChem (CID 10574530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).