2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-N,N-di(propan-2-yl)acetamide

C18H22Cl2N2O2 — CID 2517642

IUPAC2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-N,N-di(propan-2-yl)acetamide
SMILESCc1ccc2c(Cl)cc(Cl)c(OCC(=O)N(C(C)C)C(C)C)c2n1
InChIInChI=1S/C18H22Cl2N2O2/c1-10(2)22(11(3)4)16(23)9-24-18-15(20)8-14(19)13-7-6-12(5)21-17(13)18/h6-8,10-11H,9H2,1-5H3
InChIKeyDCCHXOSHCIQWEJ-UHFFFAOYSA-N
MW369.29 g/mol
LogP4.87
Rot. Bonds5

About 2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-N,N-di(propan-2-yl)acetamide

2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-N,N-di(propan-2-yl)acetamide (PubChem CID 2517642) has the molecular formula C18H22Cl2N2O2 and a molecular weight of 369.29 g/mol. Its IUPAC name is 2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-N,N-di(propan-2-yl)acetamide.

Molecular Properties

Compound Name2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-N,N-di(propan-2-yl)acetamide
PubChem CID2517642
Molecular FormulaC18H22Cl2N2O2
Molecular Weight369.29 g/mol
Exact Mass368.11
IUPAC Name2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-N,N-di(propan-2-yl)acetamide
SMILESCc1ccc2c(Cl)cc(Cl)c(OCC(=O)N(C(C)C)C(C)C)c2n1
InChIInChI=1S/C18H22Cl2N2O2/c1-10(2)22(11(3)4)16(23)9-24-18-15(20)8-14(19)13-7-6-12(5)21-17(13)18/h6-8,10-11H,9H2,1-5H3
InChIKeyDCCHXOSHCIQWEJ-UHFFFAOYSA-N
XLogP4.87
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.29
LogP ≤ 54.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-N,N-di(propan-2-yl)acetamide?
The IUPAC name of 2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-N,N-di(propan-2-yl)acetamide (CID 2517642) is 2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-N,N-di(propan-2-yl)acetamide.
What is the SMILES notation for 2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-N,N-di(propan-2-yl)acetamide?
The canonical SMILES for 2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-N,N-di(propan-2-yl)acetamide is Cc1ccc2c(Cl)cc(Cl)c(OCC(=O)N(C(C)C)C(C)C)c2n1.
What is the InChIKey of 2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-N,N-di(propan-2-yl)acetamide?
The InChIKey is DCCHXOSHCIQWEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22Cl2N2O2/c1-10(2)22(11(3)4)16(23)9-24-18-15(20)8-14(19)13-7-6-12(5)21-17(13)18/h6-8,10-11H,9H2,1-5H3.
What are the key properties of 2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-N,N-di(propan-2-yl)acetamide?
2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-N,N-di(propan-2-yl)acetamide has a molecular weight of 369.29 g/mol, XLogP of 4.87, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-N,N-di(propan-2-yl)acetamide is sourced from PubChem (CID 2517642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).