2-[4,6-diethyl-2-(3-methoxypentan-3-yl)pyrimidin-5-yl]ethanamine

C16H29N3O — CID 116779466

IUPAC2-[4,6-diethyl-2-(3-methoxypentan-3-yl)pyrimidin-5-yl]ethanamine
SMILESCCc1nc(C(CC)(CC)OC)nc(CC)c1CCN
InChIInChI=1S/C16H29N3O/c1-6-13-12(10-11-17)14(7-2)19-15(18-13)16(8-3,9-4)20-5/h6-11,17H2,1-5H3
InChIKeyJRIUVKMMBRZEPD-UHFFFAOYSA-N
MW279.43 g/mol
LogP2.76
Rot. Bonds8

About 2-[4,6-diethyl-2-(3-methoxypentan-3-yl)pyrimidin-5-yl]ethanamine

2-[4,6-diethyl-2-(3-methoxypentan-3-yl)pyrimidin-5-yl]ethanamine (PubChem CID 116779466) has the molecular formula C16H29N3O and a molecular weight of 279.43 g/mol. Its IUPAC name is 2-[4,6-diethyl-2-(3-methoxypentan-3-yl)pyrimidin-5-yl]ethanamine.

Molecular Properties

Compound Name2-[4,6-diethyl-2-(3-methoxypentan-3-yl)pyrimidin-5-yl]ethanamine
PubChem CID116779466
Molecular FormulaC16H29N3O
Molecular Weight279.43 g/mol
Exact Mass279.23
IUPAC Name2-[4,6-diethyl-2-(3-methoxypentan-3-yl)pyrimidin-5-yl]ethanamine
SMILESCCc1nc(C(CC)(CC)OC)nc(CC)c1CCN
InChIInChI=1S/C16H29N3O/c1-6-13-12(10-11-17)14(7-2)19-15(18-13)16(8-3,9-4)20-5/h6-11,17H2,1-5H3
InChIKeyJRIUVKMMBRZEPD-UHFFFAOYSA-N
XLogP2.76
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.43
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(2-aminoethyl)-4-ethyl-6-methoxypyrimidin-2-amine
CID 105450108
2-(2-cyclopentyl-4,6-diethylpyrimidin-5-yl)ethanamine
CID 79219605
[6-ethyl-2-(3-methoxypentan-3-yl)pyrimidin-4-yl]hydrazine
CID 116777566
2-[4,6-diethyl-2-(3-methoxyphenyl)pyrimidin-5-yl]ethanamine
CID 79219772
2-(2-cyclohexyl-4,6-diethylpyrimidin-5-yl)ethanamine
CID 79219146
2-[4,6-diethyl-2-(4-ethylphenyl)pyrimidin-5-yl]ethanamine
CID 79219938
[3-(3-methoxypentan-3-yl)-1,2,4-oxadiazol-5-yl]methanamine
CID 116741094
2-(4,6-diethyl-2-morpholin-4-ylpyrimidin-5-yl)ethanamine
CID 79220434
2-[4,6-diethyl-2-(2-methylphenyl)pyrimidin-5-yl]ethanamine
CID 79218553
5-chloro-3-(3-methoxypentan-3-yl)-1,2,4-thiadiazole
CID 116782254
5-bromo-6-ethyl-2-(2-methoxybutan-2-yl)pyrimidin-4-amine
CID 116776732
2-(3-methoxypentan-3-yl)-N,6-dimethylpyrimidin-4-amine
CID 116775773

Frequently Asked Questions

What is the IUPAC name of 2-[4,6-diethyl-2-(3-methoxypentan-3-yl)pyrimidin-5-yl]ethanamine?
The IUPAC name of 2-[4,6-diethyl-2-(3-methoxypentan-3-yl)pyrimidin-5-yl]ethanamine (CID 116779466) is 2-[4,6-diethyl-2-(3-methoxypentan-3-yl)pyrimidin-5-yl]ethanamine.
What is the SMILES notation for 2-[4,6-diethyl-2-(3-methoxypentan-3-yl)pyrimidin-5-yl]ethanamine?
The canonical SMILES for 2-[4,6-diethyl-2-(3-methoxypentan-3-yl)pyrimidin-5-yl]ethanamine is CCc1nc(C(CC)(CC)OC)nc(CC)c1CCN.
What is the InChIKey of 2-[4,6-diethyl-2-(3-methoxypentan-3-yl)pyrimidin-5-yl]ethanamine?
The InChIKey is JRIUVKMMBRZEPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29N3O/c1-6-13-12(10-11-17)14(7-2)19-15(18-13)16(8-3,9-4)20-5/h6-11,17H2,1-5H3.
What are the key properties of 2-[4,6-diethyl-2-(3-methoxypentan-3-yl)pyrimidin-5-yl]ethanamine?
2-[4,6-diethyl-2-(3-methoxypentan-3-yl)pyrimidin-5-yl]ethanamine has a molecular weight of 279.43 g/mol, XLogP of 2.76, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4,6-diethyl-2-(3-methoxypentan-3-yl)pyrimidin-5-yl]ethanamine is sourced from PubChem (CID 116779466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).