2-(4-ethoxypyrimidin-2-yl)ethanamine

C8H13N3O — CID 112639157

IUPAC2-(4-ethoxypyrimidin-2-yl)ethanamine
SMILESCCOc1ccnc(CCN)n1
InChIInChI=1S/C8H13N3O/c1-2-12-8-4-6-10-7(11-8)3-5-9/h4,6H,2-3,5,9H2,1H3
InChIKeyFYMKUXCGIGOTGF-UHFFFAOYSA-N
MW167.21 g/mol
LogP0.38
Rot. Bonds4

About 2-(4-ethoxypyrimidin-2-yl)ethanamine

2-(4-ethoxypyrimidin-2-yl)ethanamine (PubChem CID 112639157) has the molecular formula C8H13N3O and a molecular weight of 167.21 g/mol. Its IUPAC name is 2-(4-ethoxypyrimidin-2-yl)ethanamine.

Molecular Properties

Compound Name2-(4-ethoxypyrimidin-2-yl)ethanamine
PubChem CID112639157
Molecular FormulaC8H13N3O
Molecular Weight167.21 g/mol
Exact Mass167.11
IUPAC Name2-(4-ethoxypyrimidin-2-yl)ethanamine
SMILESCCOc1ccnc(CCN)n1
InChIInChI=1S/C8H13N3O/c1-2-12-8-4-6-10-7(11-8)3-5-9/h4,6H,2-3,5,9H2,1H3
InChIKeyFYMKUXCGIGOTGF-UHFFFAOYSA-N
XLogP0.38
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.21
LogP ≤ 50.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-ethoxypyrimidin-2-yl)oxyethanamine
CID 112639005
2-[4-(4-ethoxy-3-methylphenyl)pyrimidin-2-yl]ethanamine
CID 96664975
2-(4-bromopyrimidin-2-yl)ethanamine
CID 105454055
2-(2-propylpyrimidin-4-yl)ethanamine
CID 62744687
2-[4-(dimethoxymethyl)pyrimidin-2-yl]ethanamine
CID 55262615
2-N-(4-ethoxypyrimidin-2-yl)-2-N-methylpropane-1,2-diamine
CID 104556767
2-[4-(2,3,4-trimethylphenyl)pyrimidin-2-yl]ethanamine
CID 116897730
[2-(2-ethoxyethyl)pyrimidin-4-yl]methanamine
CID 106815490
4-methoxy-2-(2-methoxyethyl)pyrimidine
CID 174759765
2-ethoxy-4-methoxypyrimidine
CID 119088608
2-[4-(2-ethoxy-3-pyridinyl)-5-methylpyrimidin-2-yl]ethanamine
CID 155225755
N-(2,5-dimethylpyrrol-1-yl)-4-ethoxypyrimidin-2-amine
CID 112638153

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethoxypyrimidin-2-yl)ethanamine?
The IUPAC name of 2-(4-ethoxypyrimidin-2-yl)ethanamine (CID 112639157) is 2-(4-ethoxypyrimidin-2-yl)ethanamine.
What is the SMILES notation for 2-(4-ethoxypyrimidin-2-yl)ethanamine?
The canonical SMILES for 2-(4-ethoxypyrimidin-2-yl)ethanamine is CCOc1ccnc(CCN)n1.
What is the InChIKey of 2-(4-ethoxypyrimidin-2-yl)ethanamine?
The InChIKey is FYMKUXCGIGOTGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3O/c1-2-12-8-4-6-10-7(11-8)3-5-9/h4,6H,2-3,5,9H2,1H3.
What are the key properties of 2-(4-ethoxypyrimidin-2-yl)ethanamine?
2-(4-ethoxypyrimidin-2-yl)ethanamine has a molecular weight of 167.21 g/mol, XLogP of 0.38, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethoxypyrimidin-2-yl)ethanamine is sourced from PubChem (CID 112639157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).