4-(2-methoxyphenoxy)-6-(2-methylquinolin-8-yl)oxypyrimidin-5-amine

C21H18N4O3 — CID 19142034

IUPAC4-(2-methoxyphenoxy)-6-(2-methylquinolin-8-yl)oxypyrimidin-5-amine
SMILESCOc1ccccc1Oc1ncnc(Oc2cccc3ccc(C)nc23)c1N
InChIInChI=1S/C21H18N4O3/c1-13-10-11-14-6-5-9-17(19(14)25-13)28-21-18(22)20(23-12-24-21)27-16-8-4-3-7-15(16)26-2/h3-12H,22H2,1-2H3
InChIKeyRQEOYDXIMDCWLY-UHFFFAOYSA-N
MW374.40 g/mol
LogP4.51
Rot. Bonds5

About 4-(2-methoxyphenoxy)-6-(2-methylquinolin-8-yl)oxypyrimidin-5-amine

4-(2-methoxyphenoxy)-6-(2-methylquinolin-8-yl)oxypyrimidin-5-amine (PubChem CID 19142034) has the molecular formula C21H18N4O3 and a molecular weight of 374.40 g/mol. Its IUPAC name is 4-(2-methoxyphenoxy)-6-(2-methylquinolin-8-yl)oxypyrimidin-5-amine.

Molecular Properties

Compound Name4-(2-methoxyphenoxy)-6-(2-methylquinolin-8-yl)oxypyrimidin-5-amine
PubChem CID19142034
Molecular FormulaC21H18N4O3
Molecular Weight374.40 g/mol
Exact Mass374.14
IUPAC Name4-(2-methoxyphenoxy)-6-(2-methylquinolin-8-yl)oxypyrimidin-5-amine
SMILESCOc1ccccc1Oc1ncnc(Oc2cccc3ccc(C)nc23)c1N
InChIInChI=1S/C21H18N4O3/c1-13-10-11-14-6-5-9-17(19(14)25-13)28-21-18(22)20(23-12-24-21)27-16-8-4-3-7-15(16)26-2/h3-12H,22H2,1-2H3
InChIKeyRQEOYDXIMDCWLY-UHFFFAOYSA-N
XLogP4.51
TPSA92.38 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.40
LogP ≤ 54.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

4-(3,4-dihydro-1H-isoquinolin-2-yl)-6-(2-methylquinolin-8-yl)oxypyrimidin-5-amine
CID 19141927
4-(2-methylquinolin-8-yl)oxy-6-morpholin-4-ylpyrimidin-5-amine
CID 19137637
2-[[5-amino-6-(2-methylquinolin-8-yl)oxypyrimidin-4-yl]-(cyanomethyl)amino]acetonitrile
CID 19141249
4-N-(4-bromophenyl)-6-(2-methylquinolin-8-yl)oxypyrimidine-4,5-diamine
CID 19141939
4-(2-methylquinolin-8-yl)oxy-6-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-5-amine
CID 19142004
4-N-(2,4-dimethylphenyl)-6-(2-methylquinolin-8-yl)oxypyrimidine-4,5-diamine
CID 19141896
2-methyl-8-pyridin-2-yloxyquinoline
CID 23934989
4-N-(1-adamantyl)-6-(2-methylquinolin-8-yl)oxypyrimidine-4,5-diamine
CID 19141897
N-[4-[[5-amino-6-(2-methylquinolin-8-yl)oxypyrimidin-4-yl]amino]phenyl]acetamide
CID 19141998
4-N-(2,5-dichlorophenyl)-6-(2-methylquinolin-8-yl)oxypyrimidine-4,5-diamine
CID 19141921
4-[4-(2,3-dimethylphenyl)piperazin-1-yl]-6-(2-methylquinolin-8-yl)oxypyrimidin-5-amine
CID 19142003
4-(2-methoxyphenoxy)-6-quinolin-8-ylsulfanylpyrimidin-5-amine
CID 19154386

Frequently Asked Questions

What is the IUPAC name of 4-(2-methoxyphenoxy)-6-(2-methylquinolin-8-yl)oxypyrimidin-5-amine?
The IUPAC name of 4-(2-methoxyphenoxy)-6-(2-methylquinolin-8-yl)oxypyrimidin-5-amine (CID 19142034) is 4-(2-methoxyphenoxy)-6-(2-methylquinolin-8-yl)oxypyrimidin-5-amine.
What is the SMILES notation for 4-(2-methoxyphenoxy)-6-(2-methylquinolin-8-yl)oxypyrimidin-5-amine?
The canonical SMILES for 4-(2-methoxyphenoxy)-6-(2-methylquinolin-8-yl)oxypyrimidin-5-amine is COc1ccccc1Oc1ncnc(Oc2cccc3ccc(C)nc23)c1N.
What is the InChIKey of 4-(2-methoxyphenoxy)-6-(2-methylquinolin-8-yl)oxypyrimidin-5-amine?
The InChIKey is RQEOYDXIMDCWLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18N4O3/c1-13-10-11-14-6-5-9-17(19(14)25-13)28-21-18(22)20(23-12-24-21)27-16-8-4-3-7-15(16)26-2/h3-12H,22H2,1-2H3.
What are the key properties of 4-(2-methoxyphenoxy)-6-(2-methylquinolin-8-yl)oxypyrimidin-5-amine?
4-(2-methoxyphenoxy)-6-(2-methylquinolin-8-yl)oxypyrimidin-5-amine has a molecular weight of 374.40 g/mol, XLogP of 4.51, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methoxyphenoxy)-6-(2-methylquinolin-8-yl)oxypyrimidin-5-amine is sourced from PubChem (CID 19142034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).