5-ethyl-6-[(4-methoxyphenyl)methoxy]-N-methylpyrimidin-4-amine

C15H19N3O2 — CID 80867429

IUPAC5-ethyl-6-[(4-methoxyphenyl)methoxy]-N-methylpyrimidin-4-amine
SMILESCCc1c(NC)ncnc1OCc1ccc(OC)cc1
InChIInChI=1S/C15H19N3O2/c1-4-13-14(16-2)17-10-18-15(13)20-9-11-5-7-12(19-3)8-6-11/h5-8,10H,4,9H2,1-3H3,(H,16,17,18)
InChIKeyJQRPGDMQTMEYRN-UHFFFAOYSA-N
MW273.34 g/mol
LogP2.67
Rot. Bonds6

About 5-ethyl-6-[(4-methoxyphenyl)methoxy]-N-methylpyrimidin-4-amine

5-ethyl-6-[(4-methoxyphenyl)methoxy]-N-methylpyrimidin-4-amine (PubChem CID 80867429) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is 5-ethyl-6-[(4-methoxyphenyl)methoxy]-N-methylpyrimidin-4-amine.

Molecular Properties

Compound Name5-ethyl-6-[(4-methoxyphenyl)methoxy]-N-methylpyrimidin-4-amine
PubChem CID80867429
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC Name5-ethyl-6-[(4-methoxyphenyl)methoxy]-N-methylpyrimidin-4-amine
SMILESCCc1c(NC)ncnc1OCc1ccc(OC)cc1
InChIInChI=1S/C15H19N3O2/c1-4-13-14(16-2)17-10-18-15(13)20-9-11-5-7-12(19-3)8-6-11/h5-8,10H,4,9H2,1-3H3,(H,16,17,18)
InChIKeyJQRPGDMQTMEYRN-UHFFFAOYSA-N
XLogP2.67
TPSA56.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-[(4-methoxyphenyl)methoxy]-N-methyl-5-propylpyrimidin-4-amine
CID 80845675
[5-ethyl-6-[(4-methoxyphenyl)methoxy]pyrimidin-4-yl]hydrazine
CID 80913387
6-[(4-bromophenyl)methoxy]-5-ethyl-N-methylpyrimidin-4-amine
CID 82825139
5-ethyl-4-N-(4-methoxyphenyl)-6-N-methylpyrimidine-4,6-diamine
CID 80760040
5-ethyl-N-methyl-6-(4-propylphenoxy)pyrimidin-4-amine
CID 80880121
6-[(3-chlorophenyl)methoxy]-5-ethyl-N-methylpyrimidin-4-amine
CID 80876248
6-butoxy-5-ethyl-N-methylpyrimidin-4-amine
CID 80866739
[6-[(4-chlorophenyl)methoxy]-5-ethylpyrimidin-4-yl]hydrazine
CID 80922291
6-[(2-chlorophenyl)methoxy]-5-ethyl-N-methylpyrimidin-4-amine
CID 80859300
5-ethyl-6-[3-(methoxymethyl)phenoxy]-N-methylpyrimidin-4-amine
CID 80876118
6-[(4-methoxyphenyl)methoxy]-N-methylpyridin-2-amine
CID 80865107
5-iodo-4-[(4-methoxyphenyl)methoxy]pyrimidine
CID 66317781

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-6-[(4-methoxyphenyl)methoxy]-N-methylpyrimidin-4-amine?
The IUPAC name of 5-ethyl-6-[(4-methoxyphenyl)methoxy]-N-methylpyrimidin-4-amine (CID 80867429) is 5-ethyl-6-[(4-methoxyphenyl)methoxy]-N-methylpyrimidin-4-amine.
What is the SMILES notation for 5-ethyl-6-[(4-methoxyphenyl)methoxy]-N-methylpyrimidin-4-amine?
The canonical SMILES for 5-ethyl-6-[(4-methoxyphenyl)methoxy]-N-methylpyrimidin-4-amine is CCc1c(NC)ncnc1OCc1ccc(OC)cc1.
What is the InChIKey of 5-ethyl-6-[(4-methoxyphenyl)methoxy]-N-methylpyrimidin-4-amine?
The InChIKey is JQRPGDMQTMEYRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2/c1-4-13-14(16-2)17-10-18-15(13)20-9-11-5-7-12(19-3)8-6-11/h5-8,10H,4,9H2,1-3H3,(H,16,17,18).
What are the key properties of 5-ethyl-6-[(4-methoxyphenyl)methoxy]-N-methylpyrimidin-4-amine?
5-ethyl-6-[(4-methoxyphenyl)methoxy]-N-methylpyrimidin-4-amine has a molecular weight of 273.34 g/mol, XLogP of 2.67, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-6-[(4-methoxyphenyl)methoxy]-N-methylpyrimidin-4-amine is sourced from PubChem (CID 80867429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).