4-[(5,7-dichloro-2-methylquinolin-8-yl)oxymethyl]benzamide

C18H14Cl2N2O2 — CID 27311006

IUPAC4-[(5,7-dichloro-2-methylquinolin-8-yl)oxymethyl]benzamide
SMILESCc1ccc2c(Cl)cc(Cl)c(OCc3ccc(C(N)=O)cc3)c2n1
InChIInChI=1S/C18H14Cl2N2O2/c1-10-2-7-13-14(19)8-15(20)17(16(13)22-10)24-9-11-3-5-12(6-4-11)18(21)23/h2-8H,9H2,1H3,(H2,21,23)
InChIKeyURFLCNFIEOQUHC-UHFFFAOYSA-N
MW361.23 g/mol
LogP4.53
Rot. Bonds4

About 4-[(5,7-dichloro-2-methylquinolin-8-yl)oxymethyl]benzamide

4-[(5,7-dichloro-2-methylquinolin-8-yl)oxymethyl]benzamide (PubChem CID 27311006) has the molecular formula C18H14Cl2N2O2 and a molecular weight of 361.23 g/mol. Its IUPAC name is 4-[(5,7-dichloro-2-methylquinolin-8-yl)oxymethyl]benzamide.

Molecular Properties

Compound Name4-[(5,7-dichloro-2-methylquinolin-8-yl)oxymethyl]benzamide
PubChem CID27311006
Molecular FormulaC18H14Cl2N2O2
Molecular Weight361.23 g/mol
Exact Mass360.04
IUPAC Name4-[(5,7-dichloro-2-methylquinolin-8-yl)oxymethyl]benzamide
SMILESCc1ccc2c(Cl)cc(Cl)c(OCc3ccc(C(N)=O)cc3)c2n1
InChIInChI=1S/C18H14Cl2N2O2/c1-10-2-7-13-14(19)8-15(20)17(16(13)22-10)24-9-11-3-5-12(6-4-11)18(21)23/h2-8H,9H2,1H3,(H2,21,23)
InChIKeyURFLCNFIEOQUHC-UHFFFAOYSA-N
XLogP4.53
TPSA65.21 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.23
LogP ≤ 54.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3,5-dichloro-4-[(4-methylphenyl)methoxy]benzamide
CID 91682782
2-amino-3-(5,7-dichloro-2-methylquinolin-8-yl)oxypropanoic acid
CID 65442005
[2-(methylamino)-2-oxoethyl] 2-(5,7-dichloro-2-methylquinolin-8-yl)oxyacetate
CID 4595999
8-[(4-tert-butyl-2,6-dimethylphenyl)methoxy]-5,7-dichloro-2-methylquinoline
CID 4213603
(2-cyanophenyl)methyl 2-(5,7-dichloro-2-methylquinolin-8-yl)oxyacetate
CID 8887751
(5,7-dichloro-2-methylquinolin-8-yl) 2-(4-bromophenyl)acetate
CID 5021915
N-[2-(5,7-dichloro-2-methylquinolin-8-yl)oxyacetyl]benzamide
CID 16569547
N-(cyclopropylmethyl)-2-(5,7-dichloro-2-methylquinolin-8-yl)oxyacetamide
CID 30432553
2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-N-naphthalen-2-ylacetamide
CID 7997855
N-benzyl-2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-N-(2-phenylethyl)acetamide
CID 23797082
4-[(2,3,5,6-tetrafluorophenoxy)methyl]benzamide
CID 17424462
4-[(4-carbamoylphenyl)methoxy]-3-chlorobenzoic acid
CID 60711874

Frequently Asked Questions

What is the IUPAC name of 4-[(5,7-dichloro-2-methylquinolin-8-yl)oxymethyl]benzamide?
The IUPAC name of 4-[(5,7-dichloro-2-methylquinolin-8-yl)oxymethyl]benzamide (CID 27311006) is 4-[(5,7-dichloro-2-methylquinolin-8-yl)oxymethyl]benzamide.
What is the SMILES notation for 4-[(5,7-dichloro-2-methylquinolin-8-yl)oxymethyl]benzamide?
The canonical SMILES for 4-[(5,7-dichloro-2-methylquinolin-8-yl)oxymethyl]benzamide is Cc1ccc2c(Cl)cc(Cl)c(OCc3ccc(C(N)=O)cc3)c2n1.
What is the InChIKey of 4-[(5,7-dichloro-2-methylquinolin-8-yl)oxymethyl]benzamide?
The InChIKey is URFLCNFIEOQUHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14Cl2N2O2/c1-10-2-7-13-14(19)8-15(20)17(16(13)22-10)24-9-11-3-5-12(6-4-11)18(21)23/h2-8H,9H2,1H3,(H2,21,23).
What are the key properties of 4-[(5,7-dichloro-2-methylquinolin-8-yl)oxymethyl]benzamide?
4-[(5,7-dichloro-2-methylquinolin-8-yl)oxymethyl]benzamide has a molecular weight of 361.23 g/mol, XLogP of 4.53, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(5,7-dichloro-2-methylquinolin-8-yl)oxymethyl]benzamide is sourced from PubChem (CID 27311006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).