N-[8-[(2,4-dichlorophenyl)methoxy]-2-ethylimidazo[1,2-a]pyridin-3-yl]-2-fluoro-N-methylbenzamide

C24H20Cl2FN3O2 — CID 46942534

IUPACN-[8-[(2,4-dichlorophenyl)methoxy]-2-ethylimidazo[1,2-a]pyridin-3-yl]-2-fluoro-N-methylbenzamide
SMILESCCc1nc2c(OCc3ccc(Cl)cc3Cl)cccn2c1N(C)C(=O)c1ccccc1F
InChIInChI=1S/C24H20Cl2FN3O2/c1-3-20-23(29(2)24(31)17-7-4-5-8-19(17)27)30-12-6-9-21(22(30)28-20)32-14-15-10-11-16(25)13-18(15)26/h4-13H,3,14H2,1-2H3
InChIKeyNALUJAWVCDEHCO-UHFFFAOYSA-N
MW472.35 g/mol
LogP6.20
Rot. Bonds6

About N-[8-[(2,4-dichlorophenyl)methoxy]-2-ethylimidazo[1,2-a]pyridin-3-yl]-2-fluoro-N-methylbenzamide

N-[8-[(2,4-dichlorophenyl)methoxy]-2-ethylimidazo[1,2-a]pyridin-3-yl]-2-fluoro-N-methylbenzamide (PubChem CID 46942534) has the molecular formula C24H20Cl2FN3O2 and a molecular weight of 472.35 g/mol. Its IUPAC name is N-[8-[(2,4-dichlorophenyl)methoxy]-2-ethylimidazo[1,2-a]pyridin-3-yl]-2-fluoro-N-methylbenzamide.

Molecular Properties

Compound NameN-[8-[(2,4-dichlorophenyl)methoxy]-2-ethylimidazo[1,2-a]pyridin-3-yl]-2-fluoro-N-methylbenzamide
PubChem CID46942534
Molecular FormulaC24H20Cl2FN3O2
Molecular Weight472.35 g/mol
Exact Mass471.09
IUPAC NameN-[8-[(2,4-dichlorophenyl)methoxy]-2-ethylimidazo[1,2-a]pyridin-3-yl]-2-fluoro-N-methylbenzamide
SMILESCCc1nc2c(OCc3ccc(Cl)cc3Cl)cccn2c1N(C)C(=O)c1ccccc1F
InChIInChI=1S/C24H20Cl2FN3O2/c1-3-20-23(29(2)24(31)17-7-4-5-8-19(17)27)30-12-6-9-21(22(30)28-20)32-14-15-10-11-16(25)13-18(15)26/h4-13H,3,14H2,1-2H3
InChIKeyNALUJAWVCDEHCO-UHFFFAOYSA-N
XLogP6.20
TPSA46.84 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500472.35
LogP ≤ 56.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[8-[(2,4-dichlorophenyl)methoxy]-2-ethylimidazo[1,2-a]pyridin-3-yl]-2-fluoro-N-methylbenzamide?
The IUPAC name of N-[8-[(2,4-dichlorophenyl)methoxy]-2-ethylimidazo[1,2-a]pyridin-3-yl]-2-fluoro-N-methylbenzamide (CID 46942534) is N-[8-[(2,4-dichlorophenyl)methoxy]-2-ethylimidazo[1,2-a]pyridin-3-yl]-2-fluoro-N-methylbenzamide.
What is the SMILES notation for N-[8-[(2,4-dichlorophenyl)methoxy]-2-ethylimidazo[1,2-a]pyridin-3-yl]-2-fluoro-N-methylbenzamide?
The canonical SMILES for N-[8-[(2,4-dichlorophenyl)methoxy]-2-ethylimidazo[1,2-a]pyridin-3-yl]-2-fluoro-N-methylbenzamide is CCc1nc2c(OCc3ccc(Cl)cc3Cl)cccn2c1N(C)C(=O)c1ccccc1F.
What is the InChIKey of N-[8-[(2,4-dichlorophenyl)methoxy]-2-ethylimidazo[1,2-a]pyridin-3-yl]-2-fluoro-N-methylbenzamide?
The InChIKey is NALUJAWVCDEHCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20Cl2FN3O2/c1-3-20-23(29(2)24(31)17-7-4-5-8-19(17)27)30-12-6-9-21(22(30)28-20)32-14-15-10-11-16(25)13-18(15)26/h4-13H,3,14H2,1-2H3.
What are the key properties of N-[8-[(2,4-dichlorophenyl)methoxy]-2-ethylimidazo[1,2-a]pyridin-3-yl]-2-fluoro-N-methylbenzamide?
N-[8-[(2,4-dichlorophenyl)methoxy]-2-ethylimidazo[1,2-a]pyridin-3-yl]-2-fluoro-N-methylbenzamide has a molecular weight of 472.35 g/mol, XLogP of 6.20, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[8-[(2,4-dichlorophenyl)methoxy]-2-ethylimidazo[1,2-a]pyridin-3-yl]-2-fluoro-N-methylbenzamide is sourced from PubChem (CID 46942534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).