4-ethoxy-6-naphthalen-2-yloxypyrimidin-5-amine

C16H15N3O2 — CID 22543733

IUPAC4-ethoxy-6-naphthalen-2-yloxypyrimidin-5-amine
SMILESCCOc1ncnc(Oc2ccc3ccccc3c2)c1N
InChIInChI=1S/C16H15N3O2/c1-2-20-15-14(17)16(19-10-18-15)21-13-8-7-11-5-3-4-6-12(11)9-13/h3-10H,2,17H2,1H3
InChIKeySTIFHVYFDNZRJV-UHFFFAOYSA-N
MW281.31 g/mol
LogP3.40
Rot. Bonds4

About 4-ethoxy-6-naphthalen-2-yloxypyrimidin-5-amine

4-ethoxy-6-naphthalen-2-yloxypyrimidin-5-amine (PubChem CID 22543733) has the molecular formula C16H15N3O2 and a molecular weight of 281.31 g/mol. Its IUPAC name is 4-ethoxy-6-naphthalen-2-yloxypyrimidin-5-amine.

Molecular Properties

Compound Name4-ethoxy-6-naphthalen-2-yloxypyrimidin-5-amine
PubChem CID22543733
Molecular FormulaC16H15N3O2
Molecular Weight281.31 g/mol
Exact Mass281.12
IUPAC Name4-ethoxy-6-naphthalen-2-yloxypyrimidin-5-amine
SMILESCCOc1ncnc(Oc2ccc3ccccc3c2)c1N
InChIInChI=1S/C16H15N3O2/c1-2-20-15-14(17)16(19-10-18-15)21-13-8-7-11-5-3-4-6-12(11)9-13/h3-10H,2,17H2,1H3
InChIKeySTIFHVYFDNZRJV-UHFFFAOYSA-N
XLogP3.40
TPSA70.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.31
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-naphthalen-1-yloxy-6-naphthalen-2-yloxypyrimidin-5-amine
CID 22541342
4-(3-bromo-4-fluorophenoxy)-6-ethoxypyrimidin-5-amine
CID 83232697
4-N-hexadecyl-6-naphthalen-2-yloxypyrimidine-4,5-diamine
CID 22543641
4-N,4-N-bis(2-methoxyethyl)-6-naphthalen-2-yloxypyrimidine-4,5-diamine
CID 22543636
2-[4-(5-amino-6-ethoxypyrimidin-4-yl)oxyphenyl]ethanol
CID 107708420
(5-ethyl-6-naphthalen-2-yloxypyrimidin-4-yl)hydrazine
CID 80910099
4-naphthalen-2-yloxy-6-(2-phenylhydrazinyl)pyrimidin-5-amine
CID 22543654
4-(azepan-1-yl)-6-naphthalen-2-yloxypyrimidin-5-amine
CID 22543614
2-ethoxynaphthalene
CID 118978197
4-N-(3,5-dichlorophenyl)-6-naphthalen-2-yloxypyrimidine-4,5-diamine
CID 22543583
4-naphthalen-2-yloxyquinazoline
CID 31538161
4-(4-ethylphenoxy)-6-(4-methoxyphenoxy)pyrimidin-5-amine
CID 19154279

Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-6-naphthalen-2-yloxypyrimidin-5-amine?
The IUPAC name of 4-ethoxy-6-naphthalen-2-yloxypyrimidin-5-amine (CID 22543733) is 4-ethoxy-6-naphthalen-2-yloxypyrimidin-5-amine.
What is the SMILES notation for 4-ethoxy-6-naphthalen-2-yloxypyrimidin-5-amine?
The canonical SMILES for 4-ethoxy-6-naphthalen-2-yloxypyrimidin-5-amine is CCOc1ncnc(Oc2ccc3ccccc3c2)c1N.
What is the InChIKey of 4-ethoxy-6-naphthalen-2-yloxypyrimidin-5-amine?
The InChIKey is STIFHVYFDNZRJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O2/c1-2-20-15-14(17)16(19-10-18-15)21-13-8-7-11-5-3-4-6-12(11)9-13/h3-10H,2,17H2,1H3.
What are the key properties of 4-ethoxy-6-naphthalen-2-yloxypyrimidin-5-amine?
4-ethoxy-6-naphthalen-2-yloxypyrimidin-5-amine has a molecular weight of 281.31 g/mol, XLogP of 3.40, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-6-naphthalen-2-yloxypyrimidin-5-amine is sourced from PubChem (CID 22543733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).