6-ethoxy-N-ethyl-5-propylpyrimidin-4-amine

C11H19N3O — CID 80858401

IUPAC6-ethoxy-N-ethyl-5-propylpyrimidin-4-amine
SMILESCCCc1c(NCC)ncnc1OCC
InChIInChI=1S/C11H19N3O/c1-4-7-9-10(12-5-2)13-8-14-11(9)15-6-3/h8H,4-7H2,1-3H3,(H,12,13,14)
InChIKeyVBMOQGDLZXMLMH-UHFFFAOYSA-N
MW209.29 g/mol
LogP2.26
Rot. Bonds6

About 6-ethoxy-N-ethyl-5-propylpyrimidin-4-amine

6-ethoxy-N-ethyl-5-propylpyrimidin-4-amine (PubChem CID 80858401) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is 6-ethoxy-N-ethyl-5-propylpyrimidin-4-amine.

Molecular Properties

Compound Name6-ethoxy-N-ethyl-5-propylpyrimidin-4-amine
PubChem CID80858401
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name6-ethoxy-N-ethyl-5-propylpyrimidin-4-amine
SMILESCCCc1c(NCC)ncnc1OCC
InChIInChI=1S/C11H19N3O/c1-4-7-9-10(12-5-2)13-8-14-11(9)15-6-3/h8H,4-7H2,1-3H3,(H,12,13,14)
InChIKeyVBMOQGDLZXMLMH-UHFFFAOYSA-N
XLogP2.26
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-6-[(2-methylpropan-2-yl)oxy]-5-propylpyrimidin-4-amine
CID 80861209
6-(2-butoxyethoxy)-N-ethyl-5-propylpyrimidin-4-amine
CID 80861396
N-ethyl-5-propyl-6-(4,4,4-trifluorobutoxy)pyrimidin-4-amine
CID 82794971
6-ethoxy-4-N-ethylpyrimidine-4,5-diamine
CID 19135293
6-[(2-bromophenyl)methoxy]-N-ethyl-5-propylpyrimidin-4-amine
CID 82808450
4-N-ethyl-6-N-methyl-5-propylpyrimidine-4,6-diamine
CID 80770650
6-(3,5-dimethylcyclohexyl)oxy-N-ethyl-5-propylpyrimidin-4-amine
CID 80871703
6-[(3-bromophenyl)methoxy]-N-ethyl-5-propylpyrimidin-4-amine
CID 82807487
6-(2,3-dimethylphenoxy)-N-ethyl-5-propylpyrimidin-4-amine
CID 80866931
N,5-diethyl-6-heptoxypyrimidin-4-amine
CID 80862239
N-ethyl-6-[2-(1-methylpyrrolidin-2-yl)ethoxy]-5-propylpyrimidin-4-amine
CID 80879280
N-ethyl-6-(3-methoxycyclohexyl)oxy-5-propylpyrimidin-4-amine
CID 80880199

Frequently Asked Questions

What is the IUPAC name of 6-ethoxy-N-ethyl-5-propylpyrimidin-4-amine?
The IUPAC name of 6-ethoxy-N-ethyl-5-propylpyrimidin-4-amine (CID 80858401) is 6-ethoxy-N-ethyl-5-propylpyrimidin-4-amine.
What is the SMILES notation for 6-ethoxy-N-ethyl-5-propylpyrimidin-4-amine?
The canonical SMILES for 6-ethoxy-N-ethyl-5-propylpyrimidin-4-amine is CCCc1c(NCC)ncnc1OCC.
What is the InChIKey of 6-ethoxy-N-ethyl-5-propylpyrimidin-4-amine?
The InChIKey is VBMOQGDLZXMLMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-4-7-9-10(12-5-2)13-8-14-11(9)15-6-3/h8H,4-7H2,1-3H3,(H,12,13,14).
What are the key properties of 6-ethoxy-N-ethyl-5-propylpyrimidin-4-amine?
6-ethoxy-N-ethyl-5-propylpyrimidin-4-amine has a molecular weight of 209.29 g/mol, XLogP of 2.26, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethoxy-N-ethyl-5-propylpyrimidin-4-amine is sourced from PubChem (CID 80858401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).