6-(cyclohexylmethoxy)-N-ethyl-5-methylpyrimidin-4-amine

C14H23N3O — CID 80880319

IUPAC6-(cyclohexylmethoxy)-N-ethyl-5-methylpyrimidin-4-amine
SMILESCCNc1ncnc(OCC2CCCCC2)c1C
InChIInChI=1S/C14H23N3O/c1-3-15-13-11(2)14(17-10-16-13)18-9-12-7-5-4-6-8-12/h10,12H,3-9H2,1-2H3,(H,15,16,17)
InChIKeyGARWRBKTEXOJHX-UHFFFAOYSA-N
MW249.36 g/mol
LogP3.18
Rot. Bonds5

About 6-(cyclohexylmethoxy)-N-ethyl-5-methylpyrimidin-4-amine

6-(cyclohexylmethoxy)-N-ethyl-5-methylpyrimidin-4-amine (PubChem CID 80880319) has the molecular formula C14H23N3O and a molecular weight of 249.36 g/mol. Its IUPAC name is 6-(cyclohexylmethoxy)-N-ethyl-5-methylpyrimidin-4-amine.

Molecular Properties

Compound Name6-(cyclohexylmethoxy)-N-ethyl-5-methylpyrimidin-4-amine
PubChem CID80880319
Molecular FormulaC14H23N3O
Molecular Weight249.36 g/mol
Exact Mass249.18
IUPAC Name6-(cyclohexylmethoxy)-N-ethyl-5-methylpyrimidin-4-amine
SMILESCCNc1ncnc(OCC2CCCCC2)c1C
InChIInChI=1S/C14H23N3O/c1-3-15-13-11(2)14(17-10-16-13)18-9-12-7-5-4-6-8-12/h10,12H,3-9H2,1-2H3,(H,15,16,17)
InChIKeyGARWRBKTEXOJHX-UHFFFAOYSA-N
XLogP3.18
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-(cyclopentylmethoxy)-N,5-diethylpyrimidin-4-amine
CID 80877477
N-ethyl-5-methyl-6-[(1-methylpiperidin-2-yl)methoxy]pyrimidin-4-amine
CID 80876908
4-N-(2-cyclopentylethyl)-6-N-ethyl-5-methylpyrimidine-4,6-diamine
CID 80791299
4-N-(cyclohexylmethyl)-6-N-ethyl-4-N,5-dimethylpyrimidine-4,6-diamine
CID 80799644
N-[2-(cyclopropylmethoxy)ethyl]-6-ethoxy-5-methylpyrimidin-4-amine
CID 114098261
4-N-cyclohexyl-6-N-ethyl-4-N,5-dimethylpyrimidine-4,6-diamine
CID 80761845
4-N-(1-cyclohexylethyl)-6-N-ethyl-5-methylpyrimidine-4,6-diamine
CID 80827161
4-chloro-6-(cycloheptylmethoxy)-5-propylpyrimidine
CID 114248317
6-but-3-ynoxy-N-ethyl-5-methylpyrimidin-4-amine
CID 106795508
N-ethyl-6-[2-(2-methoxyethoxy)ethoxy]-5-methylpyrimidin-4-amine
CID 104568195
6-cyclopentylsulfanyl-N-ethyl-5-methylpyrimidin-4-amine
CID 80889416
[6-(cyclohexylmethoxy)-2,5-dimethylpyrimidin-4-yl]hydrazine
CID 80924193

Frequently Asked Questions

What is the IUPAC name of 6-(cyclohexylmethoxy)-N-ethyl-5-methylpyrimidin-4-amine?
The IUPAC name of 6-(cyclohexylmethoxy)-N-ethyl-5-methylpyrimidin-4-amine (CID 80880319) is 6-(cyclohexylmethoxy)-N-ethyl-5-methylpyrimidin-4-amine.
What is the SMILES notation for 6-(cyclohexylmethoxy)-N-ethyl-5-methylpyrimidin-4-amine?
The canonical SMILES for 6-(cyclohexylmethoxy)-N-ethyl-5-methylpyrimidin-4-amine is CCNc1ncnc(OCC2CCCCC2)c1C.
What is the InChIKey of 6-(cyclohexylmethoxy)-N-ethyl-5-methylpyrimidin-4-amine?
The InChIKey is GARWRBKTEXOJHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O/c1-3-15-13-11(2)14(17-10-16-13)18-9-12-7-5-4-6-8-12/h10,12H,3-9H2,1-2H3,(H,15,16,17).
What are the key properties of 6-(cyclohexylmethoxy)-N-ethyl-5-methylpyrimidin-4-amine?
6-(cyclohexylmethoxy)-N-ethyl-5-methylpyrimidin-4-amine has a molecular weight of 249.36 g/mol, XLogP of 3.18, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(cyclohexylmethoxy)-N-ethyl-5-methylpyrimidin-4-amine is sourced from PubChem (CID 80880319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).