2-(4-chlorophenoxy)-4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide

C28H22ClN3O2 — CID 58236530

IUPAC2-(4-chlorophenoxy)-4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide
SMILESCc1ccc(C(=O)Nc2ccc(-c3cn4cccc(C)c4n3)cc2)c(Oc2ccc(Cl)cc2)c1
InChIInChI=1S/C28H22ClN3O2/c1-18-5-14-24(26(16-18)34-23-12-8-21(29)9-13-23)28(33)30-22-10-6-20(7-11-22)25-17-32-15-3-4-19(2)27(32)31-25/h3-17H,1-2H3,(H,30,33)
InChIKeyHSKAZICJMTXZDI-UHFFFAOYSA-N
MW467.96 g/mol
LogP7.32
Rot. Bonds5

About 2-(4-chlorophenoxy)-4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide

2-(4-chlorophenoxy)-4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide (PubChem CID 58236530) has the molecular formula C28H22ClN3O2 and a molecular weight of 467.96 g/mol. Its IUPAC name is 2-(4-chlorophenoxy)-4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide.

Molecular Properties

Compound Name2-(4-chlorophenoxy)-4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide
PubChem CID58236530
Molecular FormulaC28H22ClN3O2
Molecular Weight467.96 g/mol
Exact Mass467.14
IUPAC Name2-(4-chlorophenoxy)-4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide
SMILESCc1ccc(C(=O)Nc2ccc(-c3cn4cccc(C)c4n3)cc2)c(Oc2ccc(Cl)cc2)c1
InChIInChI=1S/C28H22ClN3O2/c1-18-5-14-24(26(16-18)34-23-12-8-21(29)9-13-23)28(33)30-22-10-6-20(7-11-22)25-17-32-15-3-4-19(2)27(32)31-25/h3-17H,1-2H3,(H,30,33)
InChIKeyHSKAZICJMTXZDI-UHFFFAOYSA-N
XLogP7.32
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500467.96
LogP ≤ 57.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-Chlorophenyl)-5-(2-cyclopropyl-3-methylimidazo[1,2-a]pyridin-6-yl)furo[3,2-c]pyridin-4(5H)-one
CID 71816518
6-chloro-N-[[4-[4-(4-chlorophenoxy)-1-piperidyl]phenyl]methyl]-2-ethyl-imidazo[1,2-a]pyridine-3-carboxamide
CID 67401709
2-ethoxy-N-(3-(3-methylimidazo[1,2-a]pyrimidin-2-yl)phenyl)benzamide
CID 7080312
4-[[3-(4-chlorophenoxy)phenyl]methyl]-N-imidazo[1,2-a]pyridin-6-ylpiperazine-1-carboxamide
CID 46233810
4-[[3-(4-chlorophenoxy)phenyl]methyl]-N-imidazo[1,2-a]pyridin-8-ylpiperazine-1-carboxamide
CID 46233971
N-[2-(dimethylamino)ethyl]-4-[3-(4-phenoxyphenyl)-6-imidazo[1,2-a]pyrazinyl]benzamide
CID 49786470
Azole, 17
CID 53348142
[2-[7-Methyl-3-(2,4,4-trimethylpentan-2-ylamino)imidazo[1,2-a]pyridin-2-yl]phenyl] 4-ethylbenzoate
CID 3437550
[2-[7-Methyl-3-(2,4,4-trimethylpentan-2-ylamino)imidazo[1,2-a]pyridin-2-yl]phenyl] 2,4-dichlorobenzoate
CID 3533471
[2-[3-(2,4,4-Trimethylpentan-2-ylamino)imidazo[1,2-a]pyridin-2-yl]phenyl] benzoate
CID 3579118
2-methoxy-N-[2-(4-methoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]benzamide
CID 4226620
[2-[3-(2,4,4-Trimethylpentan-2-ylamino)imidazo[1,2-a]pyridin-2-yl]phenyl] 4-(trifluoromethyl)benzoate
CID 4434471

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenoxy)-4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide?
The IUPAC name of 2-(4-chlorophenoxy)-4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide (CID 58236530) is 2-(4-chlorophenoxy)-4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide.
What is the SMILES notation for 2-(4-chlorophenoxy)-4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide?
The canonical SMILES for 2-(4-chlorophenoxy)-4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide is Cc1ccc(C(=O)Nc2ccc(-c3cn4cccc(C)c4n3)cc2)c(Oc2ccc(Cl)cc2)c1.
What is the InChIKey of 2-(4-chlorophenoxy)-4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide?
The InChIKey is HSKAZICJMTXZDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H22ClN3O2/c1-18-5-14-24(26(16-18)34-23-12-8-21(29)9-13-23)28(33)30-22-10-6-20(7-11-22)25-17-32-15-3-4-19(2)27(32)31-25/h3-17H,1-2H3,(H,30,33).
What are the key properties of 2-(4-chlorophenoxy)-4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide?
2-(4-chlorophenoxy)-4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide has a molecular weight of 467.96 g/mol, XLogP of 7.32, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenoxy)-4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide is sourced from PubChem (CID 58236530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).