3-(6-chloroimidazo[1,2-a]pyridin-3-yl)-N-[(4-fluorophenyl)methyl]-3-phenylpropanamide

C23H19ClFN3O — CID 4611202

IUPAC3-(6-chloroimidazo[1,2-a]pyridin-3-yl)-N-[(4-fluorophenyl)methyl]-3-phenylpropanamide
SMILESO=C(CC(c1ccccc1)c1cnc2ccc(Cl)cn12)NCc1ccc(F)cc1
InChIInChI=1S/C23H19ClFN3O/c24-18-8-11-22-26-14-21(28(22)15-18)20(17-4-2-1-3-5-17)12-23(29)27-13-16-6-9-19(25)10-7-16/h1-11,14-15,20H,12-13H2,(H,27,29)
InChIKeyONZSVTNKHKDWQY-UHFFFAOYSA-N
MW407.88 g/mol
LogP4.97
Rot. Bonds6

About 3-(6-chloroimidazo[1,2-a]pyridin-3-yl)-N-[(4-fluorophenyl)methyl]-3-phenylpropanamide

3-(6-chloroimidazo[1,2-a]pyridin-3-yl)-N-[(4-fluorophenyl)methyl]-3-phenylpropanamide (PubChem CID 4611202) has the molecular formula C23H19ClFN3O and a molecular weight of 407.88 g/mol. Its IUPAC name is 3-(6-chloroimidazo[1,2-a]pyridin-3-yl)-N-[(4-fluorophenyl)methyl]-3-phenylpropanamide.

Molecular Properties

Compound Name3-(6-chloroimidazo[1,2-a]pyridin-3-yl)-N-[(4-fluorophenyl)methyl]-3-phenylpropanamide
PubChem CID4611202
Molecular FormulaC23H19ClFN3O
Molecular Weight407.88 g/mol
Exact Mass407.12
IUPAC Name3-(6-chloroimidazo[1,2-a]pyridin-3-yl)-N-[(4-fluorophenyl)methyl]-3-phenylpropanamide
SMILESO=C(CC(c1ccccc1)c1cnc2ccc(Cl)cn12)NCc1ccc(F)cc1
InChIInChI=1S/C23H19ClFN3O/c24-18-8-11-22-26-14-21(28(22)15-18)20(17-4-2-1-3-5-17)12-23(29)27-13-16-6-9-19(25)10-7-16/h1-11,14-15,20H,12-13H2,(H,27,29)
InChIKeyONZSVTNKHKDWQY-UHFFFAOYSA-N
XLogP4.97
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500407.88
LogP ≤ 54.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(6-chloroimidazo[1,2-a]pyridin-3-yl)-3-phenyl-N-[[3-(trifluoromethyl)phenyl]methyl]propanamide
CID 4571894
3-(6-chloroimidazo[1,2-a]pyridin-3-yl)-3-(2-fluorophenyl)-N-(pyridin-3-ylmethyl)propanamide
CID 42783702
3-imidazo[1,2-a]pyridin-3-yl-3-phenyl-N-(pyridin-4-ylmethyl)propanamide
CID 42782840
3-(6-chloroimidazo[1,2-a]pyridin-3-yl)-N-(4-fluorophenyl)-3-(2-methoxyphenyl)propanamide
CID 4290443
3-(6-chloroimidazo[1,2-a]pyridin-3-yl)-3-phenyl-1-piperidin-1-ylpropan-1-one
CID 42783664
3-(4-chlorophenyl)-3-(4-fluorophenyl)-N-(pyridin-3-ylmethyl)propanamide
CID 45142910
(3S)-N-(1,3-benzodioxol-5-ylmethyl)-3-(6-chloroimidazo[1,2-a]pyridin-3-yl)-3-(3,5-dimethoxyphenyl)propanamide
CID 93011803
N-benzyl-3-imidazo[1,2-a]pyridin-3-yl-3-[3-(trifluoromethyl)phenyl]propanamide
CID 4197390
1-(4-benzylpiperidin-1-yl)-3-(6-chloroimidazo[1,2-a]pyridin-3-yl)-3-phenylpropan-1-one
CID 4227777
N-[(4-fluorophenyl)methyl]-3-(2-methylphenyl)-3-(8-phenylmethoxyimidazo[1,2-a]pyridin-3-yl)propanamide
CID 4156495
3-(6-chloroimidazo[1,2-a]pyridin-3-yl)-3-(2-fluorophenyl)-N-(2-morpholin-4-ylethyl)propanamide
CID 3378409
2-[[(3S)-3-(6-chloroimidazo[1,2-a]pyridin-3-yl)-3-(2-methoxyphenyl)propanoyl]amino]ethyl-dimethylazanium
CID 7332222

Frequently Asked Questions

What is the IUPAC name of 3-(6-chloroimidazo[1,2-a]pyridin-3-yl)-N-[(4-fluorophenyl)methyl]-3-phenylpropanamide?
The IUPAC name of 3-(6-chloroimidazo[1,2-a]pyridin-3-yl)-N-[(4-fluorophenyl)methyl]-3-phenylpropanamide (CID 4611202) is 3-(6-chloroimidazo[1,2-a]pyridin-3-yl)-N-[(4-fluorophenyl)methyl]-3-phenylpropanamide.
What is the SMILES notation for 3-(6-chloroimidazo[1,2-a]pyridin-3-yl)-N-[(4-fluorophenyl)methyl]-3-phenylpropanamide?
The canonical SMILES for 3-(6-chloroimidazo[1,2-a]pyridin-3-yl)-N-[(4-fluorophenyl)methyl]-3-phenylpropanamide is O=C(CC(c1ccccc1)c1cnc2ccc(Cl)cn12)NCc1ccc(F)cc1.
What is the InChIKey of 3-(6-chloroimidazo[1,2-a]pyridin-3-yl)-N-[(4-fluorophenyl)methyl]-3-phenylpropanamide?
The InChIKey is ONZSVTNKHKDWQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19ClFN3O/c24-18-8-11-22-26-14-21(28(22)15-18)20(17-4-2-1-3-5-17)12-23(29)27-13-16-6-9-19(25)10-7-16/h1-11,14-15,20H,12-13H2,(H,27,29).
What are the key properties of 3-(6-chloroimidazo[1,2-a]pyridin-3-yl)-N-[(4-fluorophenyl)methyl]-3-phenylpropanamide?
3-(6-chloroimidazo[1,2-a]pyridin-3-yl)-N-[(4-fluorophenyl)methyl]-3-phenylpropanamide has a molecular weight of 407.88 g/mol, XLogP of 4.97, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6-chloroimidazo[1,2-a]pyridin-3-yl)-N-[(4-fluorophenyl)methyl]-3-phenylpropanamide is sourced from PubChem (CID 4611202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).