4-[4-(2-methoxyethyl)phenoxy]pyrimidin-5-amine

C13H15N3O2 — CID 79918869

IUPAC4-[4-(2-methoxyethyl)phenoxy]pyrimidin-5-amine
SMILESCOCCc1ccc(Oc2ncncc2N)cc1
InChIInChI=1S/C13H15N3O2/c1-17-7-6-10-2-4-11(5-3-10)18-13-12(14)8-15-9-16-13/h2-5,8-9H,6-7,14H2,1H3
InChIKeyOQHLVZKMMUFUIV-UHFFFAOYSA-N
MW245.28 g/mol
LogP2.04
Rot. Bonds5

About 4-[4-(2-methoxyethyl)phenoxy]pyrimidin-5-amine

4-[4-(2-methoxyethyl)phenoxy]pyrimidin-5-amine (PubChem CID 79918869) has the molecular formula C13H15N3O2 and a molecular weight of 245.28 g/mol. Its IUPAC name is 4-[4-(2-methoxyethyl)phenoxy]pyrimidin-5-amine.

Molecular Properties

Compound Name4-[4-(2-methoxyethyl)phenoxy]pyrimidin-5-amine
PubChem CID79918869
Molecular FormulaC13H15N3O2
Molecular Weight245.28 g/mol
Exact Mass245.12
IUPAC Name4-[4-(2-methoxyethyl)phenoxy]pyrimidin-5-amine
SMILESCOCCc1ccc(Oc2ncncc2N)cc1
InChIInChI=1S/C13H15N3O2/c1-17-7-6-10-2-4-11(5-3-10)18-13-12(14)8-15-9-16-13/h2-5,8-9H,6-7,14H2,1H3
InChIKeyOQHLVZKMMUFUIV-UHFFFAOYSA-N
XLogP2.04
TPSA70.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.28
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[4-(2-methoxyethyl)phenoxy]pyridin-3-amine
CID 43352037
2-[4-(5-aminopyrimidin-4-yl)oxyphenyl]acetonitrile
CID 79916294
5-amino-6-[4-(2-methoxyethyl)phenoxy]pyridine-3-carboxylic acid
CID 81447219
5-bromo-4-[4-(2-methoxyethyl)phenoxy]pyrimidin-2-amine
CID 80874710
2-[4-(2-methoxyethyl)phenoxy]-5-methylpyridin-4-amine
CID 83267065
4-[4-(trifluoromethyl)phenoxy]pyrimidin-5-amine
CID 79917598
4-chloro-5-(chloromethyl)-6-[4-(2-methoxyethyl)phenoxy]pyrimidine
CID 107087636
5-(bromomethyl)-2-[4-(2-methoxyethyl)phenoxy]-3-methylpyridine
CID 107087634
4-fluoro-6-[4-(2-methoxyethyl)phenoxy]pyrimidine
CID 113305637
4-(2-bromo-4-methoxyphenoxy)pyrimidin-5-amine
CID 104706575
4-(5,6,7,8-tetrahydronaphthalen-2-yloxy)pyrimidin-5-amine
CID 79916312
4-(1-methoxypropan-2-yloxy)pyrimidin-5-amine
CID 79916110

Frequently Asked Questions

What is the IUPAC name of 4-[4-(2-methoxyethyl)phenoxy]pyrimidin-5-amine?
The IUPAC name of 4-[4-(2-methoxyethyl)phenoxy]pyrimidin-5-amine (CID 79918869) is 4-[4-(2-methoxyethyl)phenoxy]pyrimidin-5-amine.
What is the SMILES notation for 4-[4-(2-methoxyethyl)phenoxy]pyrimidin-5-amine?
The canonical SMILES for 4-[4-(2-methoxyethyl)phenoxy]pyrimidin-5-amine is COCCc1ccc(Oc2ncncc2N)cc1.
What is the InChIKey of 4-[4-(2-methoxyethyl)phenoxy]pyrimidin-5-amine?
The InChIKey is OQHLVZKMMUFUIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O2/c1-17-7-6-10-2-4-11(5-3-10)18-13-12(14)8-15-9-16-13/h2-5,8-9H,6-7,14H2,1H3.
What are the key properties of 4-[4-(2-methoxyethyl)phenoxy]pyrimidin-5-amine?
4-[4-(2-methoxyethyl)phenoxy]pyrimidin-5-amine has a molecular weight of 245.28 g/mol, XLogP of 2.04, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(2-methoxyethyl)phenoxy]pyrimidin-5-amine is sourced from PubChem (CID 79918869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).