2-[2-(4-chlorophenyl)-8-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dipropylacetamide

C22H26ClN3O — CID 10452566

IUPAC2-[2-(4-chlorophenyl)-8-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dipropylacetamide
SMILESCCCN(CCC)C(=O)Cc1c(-c2ccc(Cl)cc2)nc2c(C)cccn12
InChIInChI=1S/C22H26ClN3O/c1-4-12-25(13-5-2)20(27)15-19-21(17-8-10-18(23)11-9-17)24-22-16(3)7-6-14-26(19)22/h6-11,14H,4-5,12-13,15H2,1-3H3
InChIKeyJDCFAZZJMIXTCK-UHFFFAOYSA-N
MW383.92 g/mol
LogP5.15
Rot. Bonds7

About 2-[2-(4-chlorophenyl)-8-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dipropylacetamide

2-[2-(4-chlorophenyl)-8-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dipropylacetamide (PubChem CID 10452566) has the molecular formula C22H26ClN3O and a molecular weight of 383.92 g/mol. Its IUPAC name is 2-[2-(4-chlorophenyl)-8-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dipropylacetamide.

Molecular Properties

Compound Name2-[2-(4-chlorophenyl)-8-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dipropylacetamide
PubChem CID10452566
Molecular FormulaC22H26ClN3O
Molecular Weight383.92 g/mol
Exact Mass383.18
IUPAC Name2-[2-(4-chlorophenyl)-8-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dipropylacetamide
SMILESCCCN(CCC)C(=O)Cc1c(-c2ccc(Cl)cc2)nc2c(C)cccn12
InChIInChI=1S/C22H26ClN3O/c1-4-12-25(13-5-2)20(27)15-19-21(17-8-10-18(23)11-9-17)24-22-16(3)7-6-14-26(19)22/h6-11,14H,4-5,12-13,15H2,1-3H3
InChIKeyJDCFAZZJMIXTCK-UHFFFAOYSA-N
XLogP5.15
TPSA37.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500383.92
LogP ≤ 55.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(4-chlorophenyl)-8-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dipropylacetamide?
The IUPAC name of 2-[2-(4-chlorophenyl)-8-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dipropylacetamide (CID 10452566) is 2-[2-(4-chlorophenyl)-8-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dipropylacetamide.
What is the SMILES notation for 2-[2-(4-chlorophenyl)-8-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dipropylacetamide?
The canonical SMILES for 2-[2-(4-chlorophenyl)-8-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dipropylacetamide is CCCN(CCC)C(=O)Cc1c(-c2ccc(Cl)cc2)nc2c(C)cccn12.
What is the InChIKey of 2-[2-(4-chlorophenyl)-8-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dipropylacetamide?
The InChIKey is JDCFAZZJMIXTCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26ClN3O/c1-4-12-25(13-5-2)20(27)15-19-21(17-8-10-18(23)11-9-17)24-22-16(3)7-6-14-26(19)22/h6-11,14H,4-5,12-13,15H2,1-3H3.
What are the key properties of 2-[2-(4-chlorophenyl)-8-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dipropylacetamide?
2-[2-(4-chlorophenyl)-8-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dipropylacetamide has a molecular weight of 383.92 g/mol, XLogP of 5.15, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(4-chlorophenyl)-8-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dipropylacetamide is sourced from PubChem (CID 10452566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).