2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-N-(4,6-dimethylpyrimidin-2-yl)acetamide

C18H16Cl2N4O2 — CID 23878377

IUPAC2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-N-(4,6-dimethylpyrimidin-2-yl)acetamide
SMILESCc1cc(C)nc(NC(=O)COc2c(Cl)cc(Cl)c3ccc(C)nc23)n1
InChIInChI=1S/C18H16Cl2N4O2/c1-9-4-5-12-13(19)7-14(20)17(16(12)21-9)26-8-15(25)24-18-22-10(2)6-11(3)23-18/h4-7H,8H2,1-3H3,(H,22,23,24,25)
InChIKeyGAALLVILRZNCPK-UHFFFAOYSA-N
MW391.26 g/mol
LogP4.27
Rot. Bonds4

About 2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-N-(4,6-dimethylpyrimidin-2-yl)acetamide

2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-N-(4,6-dimethylpyrimidin-2-yl)acetamide (PubChem CID 23878377) has the molecular formula C18H16Cl2N4O2 and a molecular weight of 391.26 g/mol. Its IUPAC name is 2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-N-(4,6-dimethylpyrimidin-2-yl)acetamide.

Molecular Properties

Compound Name2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-N-(4,6-dimethylpyrimidin-2-yl)acetamide
PubChem CID23878377
Molecular FormulaC18H16Cl2N4O2
Molecular Weight391.26 g/mol
Exact Mass390.07
IUPAC Name2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-N-(4,6-dimethylpyrimidin-2-yl)acetamide
SMILESCc1cc(C)nc(NC(=O)COc2c(Cl)cc(Cl)c3ccc(C)nc23)n1
InChIInChI=1S/C18H16Cl2N4O2/c1-9-4-5-12-13(19)7-14(20)17(16(12)21-9)26-8-15(25)24-18-22-10(2)6-11(3)23-18/h4-7H,8H2,1-3H3,(H,22,23,24,25)
InChIKeyGAALLVILRZNCPK-UHFFFAOYSA-N
XLogP4.27
TPSA77.00 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.26
LogP ≤ 54.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-N-naphthalen-2-ylacetamide
CID 7997855
2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-N-(1,3-thiazol-2-yl)acetamide
CID 2536958
N-[2-(5,7-dichloro-2-methylquinolin-8-yl)oxyacetyl]-2-phenylacetamide
CID 16568919
2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-N-(2-methoxyphenyl)acetamide
CID 2431077
N-[3,5-bis(trifluoromethyl)phenyl]-2-(5,7-dichloro-2-methylquinolin-8-yl)oxyacetamide
CID 4590286
2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-N-(ethylcarbamoyl)acetamide
CID 2628295
N-(cyclopropylmethyl)-2-(5,7-dichloro-2-methylquinolin-8-yl)oxyacetamide
CID 30432553
1-(5,7-dichloro-2-methylquinolin-8-yl)oxypentan-2-one
CID 62041878
N-[2-(5,7-dichloro-2-methylquinolin-8-yl)oxyacetyl]benzamide
CID 16569547
(2-anilino-2-oxoethyl) 2-(5,7-dichloro-2-methylquinolin-8-yl)oxyacetate
CID 2667497
2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-N-(2-phenoxyphenyl)acetamide
CID 23908018
N-[2-(4-chlorophenyl)sulfanylphenyl]-2-(5,7-dichloro-2-methylquinolin-8-yl)oxyacetamide
CID 23819705

Frequently Asked Questions

What is the IUPAC name of 2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-N-(4,6-dimethylpyrimidin-2-yl)acetamide?
The IUPAC name of 2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-N-(4,6-dimethylpyrimidin-2-yl)acetamide (CID 23878377) is 2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-N-(4,6-dimethylpyrimidin-2-yl)acetamide.
What is the SMILES notation for 2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-N-(4,6-dimethylpyrimidin-2-yl)acetamide?
The canonical SMILES for 2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-N-(4,6-dimethylpyrimidin-2-yl)acetamide is Cc1cc(C)nc(NC(=O)COc2c(Cl)cc(Cl)c3ccc(C)nc23)n1.
What is the InChIKey of 2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-N-(4,6-dimethylpyrimidin-2-yl)acetamide?
The InChIKey is GAALLVILRZNCPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16Cl2N4O2/c1-9-4-5-12-13(19)7-14(20)17(16(12)21-9)26-8-15(25)24-18-22-10(2)6-11(3)23-18/h4-7H,8H2,1-3H3,(H,22,23,24,25).
What are the key properties of 2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-N-(4,6-dimethylpyrimidin-2-yl)acetamide?
2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-N-(4,6-dimethylpyrimidin-2-yl)acetamide has a molecular weight of 391.26 g/mol, XLogP of 4.27, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-N-(4,6-dimethylpyrimidin-2-yl)acetamide is sourced from PubChem (CID 23878377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).