4-[2-[di(propan-2-yl)amino]ethoxy]-6-ethoxypyrimidin-5-amine

C14H26N4O2 — CID 115505378

IUPAC4-[2-[di(propan-2-yl)amino]ethoxy]-6-ethoxypyrimidin-5-amine
SMILESCCOc1ncnc(OCCN(C(C)C)C(C)C)c1N
InChIInChI=1S/C14H26N4O2/c1-6-19-13-12(15)14(17-9-16-13)20-8-7-18(10(2)3)11(4)5/h9-11H,6-8,15H2,1-5H3
InChIKeyBBYHQIFZEGXLDH-UHFFFAOYSA-N
MW282.39 g/mol
LogP1.96
Rot. Bonds8

About 4-[2-[di(propan-2-yl)amino]ethoxy]-6-ethoxypyrimidin-5-amine

4-[2-[di(propan-2-yl)amino]ethoxy]-6-ethoxypyrimidin-5-amine (PubChem CID 115505378) has the molecular formula C14H26N4O2 and a molecular weight of 282.39 g/mol. Its IUPAC name is 4-[2-[di(propan-2-yl)amino]ethoxy]-6-ethoxypyrimidin-5-amine.

Molecular Properties

Compound Name4-[2-[di(propan-2-yl)amino]ethoxy]-6-ethoxypyrimidin-5-amine
PubChem CID115505378
Molecular FormulaC14H26N4O2
Molecular Weight282.39 g/mol
Exact Mass282.21
IUPAC Name4-[2-[di(propan-2-yl)amino]ethoxy]-6-ethoxypyrimidin-5-amine
SMILESCCOc1ncnc(OCCN(C(C)C)C(C)C)c1N
InChIInChI=1S/C14H26N4O2/c1-6-19-13-12(15)14(17-9-16-13)20-8-7-18(10(2)3)11(4)5/h9-11H,6-8,15H2,1-5H3
InChIKeyBBYHQIFZEGXLDH-UHFFFAOYSA-N
XLogP1.96
TPSA73.50 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-ethoxy-6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]pyrimidin-5-amine
CID 104559912
5-amino-6-[2-[di(propan-2-yl)amino]ethoxy]pyridine-3-carbonitrile
CID 103469781
4-ethoxy-6-(1-propan-2-ylpyrazol-4-yl)oxypyrimidin-5-amine
CID 116800587
5-amino-2-[2-[di(propan-2-yl)amino]ethoxy]pyridine-3-carboxamide
CID 115505405
6-[2-[di(propan-2-yl)amino]ethoxy]pyridin-2-amine
CID 113325043
3-[2-[di(propan-2-yl)amino]ethoxy]pyrazine-2-carbothioamide
CID 115505522
6-ethoxy-4-N-ethylpyrimidine-4,5-diamine
CID 19135293
3-(2,5-diamino-6-ethoxypyrimidin-4-yl)oxypropan-1-ol
CID 118188233
2-[(5-amino-6-ethoxypyrimidin-4-yl)-(2-methoxyethyl)amino]ethanol
CID 113467648
5-[2-[di(propan-2-yl)amino]ethoxy]-1-ethyl-3-methylpyrazol-4-amine
CID 115505356
N-[2-[[3-(aminomethyl)-6-methyl-2-pyridinyl]oxy]ethyl]-N-propan-2-ylpropan-2-amine
CID 115505333
3-[2-[di(propan-2-yl)amino]ethoxy]pyrazine-2-carbonitrile
CID 115505505

Frequently Asked Questions

What is the IUPAC name of 4-[2-[di(propan-2-yl)amino]ethoxy]-6-ethoxypyrimidin-5-amine?
The IUPAC name of 4-[2-[di(propan-2-yl)amino]ethoxy]-6-ethoxypyrimidin-5-amine (CID 115505378) is 4-[2-[di(propan-2-yl)amino]ethoxy]-6-ethoxypyrimidin-5-amine.
What is the SMILES notation for 4-[2-[di(propan-2-yl)amino]ethoxy]-6-ethoxypyrimidin-5-amine?
The canonical SMILES for 4-[2-[di(propan-2-yl)amino]ethoxy]-6-ethoxypyrimidin-5-amine is CCOc1ncnc(OCCN(C(C)C)C(C)C)c1N.
What is the InChIKey of 4-[2-[di(propan-2-yl)amino]ethoxy]-6-ethoxypyrimidin-5-amine?
The InChIKey is BBYHQIFZEGXLDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4O2/c1-6-19-13-12(15)14(17-9-16-13)20-8-7-18(10(2)3)11(4)5/h9-11H,6-8,15H2,1-5H3.
What are the key properties of 4-[2-[di(propan-2-yl)amino]ethoxy]-6-ethoxypyrimidin-5-amine?
4-[2-[di(propan-2-yl)amino]ethoxy]-6-ethoxypyrimidin-5-amine has a molecular weight of 282.39 g/mol, XLogP of 1.96, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[di(propan-2-yl)amino]ethoxy]-6-ethoxypyrimidin-5-amine is sourced from PubChem (CID 115505378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).