3-(5-chloro-8-hydroxyquinolin-7-yl)-3-(2-chlorophenyl)-2-phenylpropanamide

C24H18Cl2N2O2 — CID 173159899

IUPAC3-(5-chloro-8-hydroxyquinolin-7-yl)-3-(2-chlorophenyl)-2-phenylpropanamide
SMILESNC(=O)C(c1ccccc1)C(c1ccccc1Cl)c1cc(Cl)c2cccnc2c1O
InChIInChI=1S/C24H18Cl2N2O2/c25-18-11-5-4-9-15(18)21(20(24(27)30)14-7-2-1-3-8-14)17-13-19(26)16-10-6-12-28-22(16)23(17)29/h1-13,20-21,29H,(H2,27,30)
InChIKeyWWPDRPQJPCXRIP-UHFFFAOYSA-N
MW437.33 g/mol
LogP5.65
Rot. Bonds5

About 3-(5-chloro-8-hydroxyquinolin-7-yl)-3-(2-chlorophenyl)-2-phenylpropanamide

3-(5-chloro-8-hydroxyquinolin-7-yl)-3-(2-chlorophenyl)-2-phenylpropanamide (PubChem CID 173159899) has the molecular formula C24H18Cl2N2O2 and a molecular weight of 437.33 g/mol. Its IUPAC name is 3-(5-chloro-8-hydroxyquinolin-7-yl)-3-(2-chlorophenyl)-2-phenylpropanamide.

Molecular Properties

Compound Name3-(5-chloro-8-hydroxyquinolin-7-yl)-3-(2-chlorophenyl)-2-phenylpropanamide
PubChem CID173159899
Molecular FormulaC24H18Cl2N2O2
Molecular Weight437.33 g/mol
Exact Mass436.07
IUPAC Name3-(5-chloro-8-hydroxyquinolin-7-yl)-3-(2-chlorophenyl)-2-phenylpropanamide
SMILESNC(=O)C(c1ccccc1)C(c1ccccc1Cl)c1cc(Cl)c2cccnc2c1O
InChIInChI=1S/C24H18Cl2N2O2/c25-18-11-5-4-9-15(18)21(20(24(27)30)14-7-2-1-3-8-14)17-13-19(26)16-10-6-12-28-22(16)23(17)29/h1-13,20-21,29H,(H2,27,30)
InChIKeyWWPDRPQJPCXRIP-UHFFFAOYSA-N
XLogP5.65
TPSA76.21 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500437.33
LogP ≤ 55.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(5-chloro-8-hydroxyquinolin-7-yl)-phenylmethyl]benzamide
CID 24958912
2-chloro-N-[(5-chloro-8-hydroxyquinolin-7-yl)-(2-chlorophenyl)methyl]acetamide
CID 67171600
[1-(5-chloro-8-hydroxyquinolin-7-yl)-2-phenylethyl]carbamic acid
CID 69307133
5-chloro-7-pentan-3-ylquinolin-8-ol
CID 91402893
3-(5-chloro-8-hydroxyquinolin-7-yl)-3-(cyclohexen-1-yl)-2-phenoxypropanamide
CID 173160189
N-[(5-chloro-8-hydroxyquinolin-7-yl)-(2-chlorophenyl)methyl]-2-phenoxyacetamide;N-[(5-chloro-8-hydroxyquinolin-7-yl)-(4-methylphenyl)methyl]-2-phenoxyacetamide
CID 161339041
1-[(5-chloro-8-hydroxyquinolin-7-yl)-pyridin-3-ylmethyl]cyclopropane-1-carboxamide
CID 175779749
5-chloro-7-[hydroxy(pyridin-3-yl)methyl]quinolin-8-ol
CID 146026296
N-[(5-chloro-8-hydroxyquinolin-7-yl)-(4-methylphenyl)methyl]acetamide
CID 2920402
5-chloro-8-hydroxyquinoline-7-carboxylic acid
CID 14534767
N-[(5-chloro-8-hydroxyquinolin-7-yl)-(4-chlorophenyl)methyl]acetamide
CID 3136129
N-[(5-chloro-8-hydroxyquinolin-7-yl)-(4-methylphenyl)methyl]-2-methylpropanamide
CID 3138762

Frequently Asked Questions

What is the IUPAC name of 3-(5-chloro-8-hydroxyquinolin-7-yl)-3-(2-chlorophenyl)-2-phenylpropanamide?
The IUPAC name of 3-(5-chloro-8-hydroxyquinolin-7-yl)-3-(2-chlorophenyl)-2-phenylpropanamide (CID 173159899) is 3-(5-chloro-8-hydroxyquinolin-7-yl)-3-(2-chlorophenyl)-2-phenylpropanamide.
What is the SMILES notation for 3-(5-chloro-8-hydroxyquinolin-7-yl)-3-(2-chlorophenyl)-2-phenylpropanamide?
The canonical SMILES for 3-(5-chloro-8-hydroxyquinolin-7-yl)-3-(2-chlorophenyl)-2-phenylpropanamide is NC(=O)C(c1ccccc1)C(c1ccccc1Cl)c1cc(Cl)c2cccnc2c1O.
What is the InChIKey of 3-(5-chloro-8-hydroxyquinolin-7-yl)-3-(2-chlorophenyl)-2-phenylpropanamide?
The InChIKey is WWPDRPQJPCXRIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H18Cl2N2O2/c25-18-11-5-4-9-15(18)21(20(24(27)30)14-7-2-1-3-8-14)17-13-19(26)16-10-6-12-28-22(16)23(17)29/h1-13,20-21,29H,(H2,27,30).
What are the key properties of 3-(5-chloro-8-hydroxyquinolin-7-yl)-3-(2-chlorophenyl)-2-phenylpropanamide?
3-(5-chloro-8-hydroxyquinolin-7-yl)-3-(2-chlorophenyl)-2-phenylpropanamide has a molecular weight of 437.33 g/mol, XLogP of 5.65, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-chloro-8-hydroxyquinolin-7-yl)-3-(2-chlorophenyl)-2-phenylpropanamide is sourced from PubChem (CID 173159899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).