6-ethyl-2-(1-methoxybutyl)-N,5-dimethylpyrimidin-4-amine

C13H23N3O — CID 116729190

IUPAC6-ethyl-2-(1-methoxybutyl)-N,5-dimethylpyrimidin-4-amine
SMILESCCCC(OC)c1nc(CC)c(C)c(NC)n1
InChIInChI=1S/C13H23N3O/c1-6-8-11(17-5)13-15-10(7-2)9(3)12(14-4)16-13/h11H,6-8H2,1-5H3,(H,14,15,16)
InChIKeyZKCCYHVYBMFYFY-UHFFFAOYSA-N
MW237.35 g/mol
LogP2.88
Rot. Bonds6

About 6-ethyl-2-(1-methoxybutyl)-N,5-dimethylpyrimidin-4-amine

6-ethyl-2-(1-methoxybutyl)-N,5-dimethylpyrimidin-4-amine (PubChem CID 116729190) has the molecular formula C13H23N3O and a molecular weight of 237.35 g/mol. Its IUPAC name is 6-ethyl-2-(1-methoxybutyl)-N,5-dimethylpyrimidin-4-amine.

Molecular Properties

Compound Name6-ethyl-2-(1-methoxybutyl)-N,5-dimethylpyrimidin-4-amine
PubChem CID116729190
Molecular FormulaC13H23N3O
Molecular Weight237.35 g/mol
Exact Mass237.18
IUPAC Name6-ethyl-2-(1-methoxybutyl)-N,5-dimethylpyrimidin-4-amine
SMILESCCCC(OC)c1nc(CC)c(C)c(NC)n1
InChIInChI=1S/C13H23N3O/c1-6-8-11(17-5)13-15-10(7-2)9(3)12(14-4)16-13/h11H,6-8H2,1-5H3,(H,14,15,16)
InChIKeyZKCCYHVYBMFYFY-UHFFFAOYSA-N
XLogP2.88
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.35
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(1-methoxybutyl)-N,5-dimethyl-6-phenylpyrimidin-4-amine
CID 116730198
6-ethyl-N,5-dimethyl-2-propan-2-ylpyrimidin-4-amine
CID 63560963
2-butan-2-yl-6-ethyl-N,5-dimethylpyrimidin-4-amine
CID 63560396
5-iodo-2-(1-methoxybutyl)-N-methyl-6-propan-2-ylpyrimidin-4-amine
CID 116729669
2-[cyclohexyl(methoxy)methyl]-6-ethyl-N,5-dimethylpyrimidin-4-amine
CID 116776346
6-ethyl-5-iodo-2-(1-methoxybutyl)pyrimidin-4-amine
CID 116729582
6-ethyl-2-(1-methoxybutyl)-N-methylpyrimidin-4-amine
CID 116728869
6-cyclopentyl-5-iodo-2-(1-methoxybutyl)-N-methylpyrimidin-4-amine
CID 116730168
N-ethyl-5-iodo-2-(1-methoxybutyl)-6-(methoxymethyl)pyrimidin-4-amine
CID 116729761
5-bromo-2-(1-methoxypropyl)-N-methyl-6-propylpyrimidin-4-amine
CID 116729394
[2-(1-ethoxypropyl)-6-ethyl-5-methylpyrimidin-4-yl]hydrazine
CID 116730430
5-bromo-2-(1-ethoxypropyl)-6-ethyl-N-methylpyrimidin-4-amine
CID 116729550

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-2-(1-methoxybutyl)-N,5-dimethylpyrimidin-4-amine?
The IUPAC name of 6-ethyl-2-(1-methoxybutyl)-N,5-dimethylpyrimidin-4-amine (CID 116729190) is 6-ethyl-2-(1-methoxybutyl)-N,5-dimethylpyrimidin-4-amine.
What is the SMILES notation for 6-ethyl-2-(1-methoxybutyl)-N,5-dimethylpyrimidin-4-amine?
The canonical SMILES for 6-ethyl-2-(1-methoxybutyl)-N,5-dimethylpyrimidin-4-amine is CCCC(OC)c1nc(CC)c(C)c(NC)n1.
What is the InChIKey of 6-ethyl-2-(1-methoxybutyl)-N,5-dimethylpyrimidin-4-amine?
The InChIKey is ZKCCYHVYBMFYFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O/c1-6-8-11(17-5)13-15-10(7-2)9(3)12(14-4)16-13/h11H,6-8H2,1-5H3,(H,14,15,16).
What are the key properties of 6-ethyl-2-(1-methoxybutyl)-N,5-dimethylpyrimidin-4-amine?
6-ethyl-2-(1-methoxybutyl)-N,5-dimethylpyrimidin-4-amine has a molecular weight of 237.35 g/mol, XLogP of 2.88, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-2-(1-methoxybutyl)-N,5-dimethylpyrimidin-4-amine is sourced from PubChem (CID 116729190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).