6-chloro-N-[[4-(4-chlorophenyl)phenyl]methyl]-2-ethylimidazo[1,2-a]pyridine-3-carboxamide

C23H19Cl2N3O — CID 53469216

IUPAC6-chloro-N-[[4-(4-chlorophenyl)phenyl]methyl]-2-ethylimidazo[1,2-a]pyridine-3-carboxamide
SMILESCCc1nc2ccc(Cl)cn2c1C(=O)NCc1ccc(-c2ccc(Cl)cc2)cc1
InChIInChI=1S/C23H19Cl2N3O/c1-2-20-22(28-14-19(25)11-12-21(28)27-20)23(29)26-13-15-3-5-16(6-4-15)17-7-9-18(24)10-8-17/h3-12,14H,2,13H2,1H3,(H,26,29)
InChIKeyLAVPQYWZXNNFLD-UHFFFAOYSA-N
MW424.33 g/mol
LogP5.80
Rot. Bonds5

About 6-chloro-N-[[4-(4-chlorophenyl)phenyl]methyl]-2-ethylimidazo[1,2-a]pyridine-3-carboxamide

6-chloro-N-[[4-(4-chlorophenyl)phenyl]methyl]-2-ethylimidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 53469216) has the molecular formula C23H19Cl2N3O and a molecular weight of 424.33 g/mol. Its IUPAC name is 6-chloro-N-[[4-(4-chlorophenyl)phenyl]methyl]-2-ethylimidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-chloro-N-[[4-(4-chlorophenyl)phenyl]methyl]-2-ethylimidazo[1,2-a]pyridine-3-carboxamide
PubChem CID53469216
Molecular FormulaC23H19Cl2N3O
Molecular Weight424.33 g/mol
Exact Mass423.09
IUPAC Name6-chloro-N-[[4-(4-chlorophenyl)phenyl]methyl]-2-ethylimidazo[1,2-a]pyridine-3-carboxamide
SMILESCCc1nc2ccc(Cl)cn2c1C(=O)NCc1ccc(-c2ccc(Cl)cc2)cc1
InChIInChI=1S/C23H19Cl2N3O/c1-2-20-22(28-14-19(25)11-12-21(28)27-20)23(29)26-13-15-3-5-16(6-4-15)17-7-9-18(24)10-8-17/h3-12,14H,2,13H2,1H3,(H,26,29)
InChIKeyLAVPQYWZXNNFLD-UHFFFAOYSA-N
XLogP5.80
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500424.33
LogP ≤ 55.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-[[4-(4-chlorophenyl)phenyl]methyl]-2-ethylimidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of 6-chloro-N-[[4-(4-chlorophenyl)phenyl]methyl]-2-ethylimidazo[1,2-a]pyridine-3-carboxamide (CID 53469216) is 6-chloro-N-[[4-(4-chlorophenyl)phenyl]methyl]-2-ethylimidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for 6-chloro-N-[[4-(4-chlorophenyl)phenyl]methyl]-2-ethylimidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for 6-chloro-N-[[4-(4-chlorophenyl)phenyl]methyl]-2-ethylimidazo[1,2-a]pyridine-3-carboxamide is CCc1nc2ccc(Cl)cn2c1C(=O)NCc1ccc(-c2ccc(Cl)cc2)cc1.
What is the InChIKey of 6-chloro-N-[[4-(4-chlorophenyl)phenyl]methyl]-2-ethylimidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is LAVPQYWZXNNFLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19Cl2N3O/c1-2-20-22(28-14-19(25)11-12-21(28)27-20)23(29)26-13-15-3-5-16(6-4-15)17-7-9-18(24)10-8-17/h3-12,14H,2,13H2,1H3,(H,26,29).
What are the key properties of 6-chloro-N-[[4-(4-chlorophenyl)phenyl]methyl]-2-ethylimidazo[1,2-a]pyridine-3-carboxamide?
6-chloro-N-[[4-(4-chlorophenyl)phenyl]methyl]-2-ethylimidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 424.33 g/mol, XLogP of 5.80, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-[[4-(4-chlorophenyl)phenyl]methyl]-2-ethylimidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 53469216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).