6-ethyl-5-methyl-2-(3-methylfuran-2-yl)pyrimidin-4-amine

C12H15N3O — CID 104806721

IUPAC6-ethyl-5-methyl-2-(3-methylfuran-2-yl)pyrimidin-4-amine
SMILESCCc1nc(-c2occc2C)nc(N)c1C
InChIInChI=1S/C12H15N3O/c1-4-9-8(3)11(13)15-12(14-9)10-7(2)5-6-16-10/h5-6H,4H2,1-3H3,(H2,13,14,15)
InChIKeyMLNJHMIMKRPKIQ-UHFFFAOYSA-N
MW217.27 g/mol
LogP2.50
Rot. Bonds2

About 6-ethyl-5-methyl-2-(3-methylfuran-2-yl)pyrimidin-4-amine

6-ethyl-5-methyl-2-(3-methylfuran-2-yl)pyrimidin-4-amine (PubChem CID 104806721) has the molecular formula C12H15N3O and a molecular weight of 217.27 g/mol. Its IUPAC name is 6-ethyl-5-methyl-2-(3-methylfuran-2-yl)pyrimidin-4-amine.

Molecular Properties

Compound Name6-ethyl-5-methyl-2-(3-methylfuran-2-yl)pyrimidin-4-amine
PubChem CID104806721
Molecular FormulaC12H15N3O
Molecular Weight217.27 g/mol
Exact Mass217.12
IUPAC Name6-ethyl-5-methyl-2-(3-methylfuran-2-yl)pyrimidin-4-amine
SMILESCCc1nc(-c2occc2C)nc(N)c1C
InChIInChI=1S/C12H15N3O/c1-4-9-8(3)11(13)15-12(14-9)10-7(2)5-6-16-10/h5-6H,4H2,1-3H3,(H2,13,14,15)
InChIKeyMLNJHMIMKRPKIQ-UHFFFAOYSA-N
XLogP2.50
TPSA64.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.27
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-ethyl-5-methyl-2-(3-methylfuran-2-yl)-N-propylpyrimidin-4-amine
CID 104806725
5-bromo-6-(methoxymethyl)-2-(3-methylfuran-2-yl)pyrimidin-4-amine
CID 104806840
5-bromo-2-(3-methylfuran-2-yl)-6-(2-methylpropyl)pyrimidin-4-amine
CID 104806896
6-ethyl-2-(3-methylfuran-2-yl)thieno[2,3-d]pyrimidin-4-amine
CID 104806564
5-bromo-2-(3-methylfuran-2-yl)-6-propan-2-ylpyrimidin-4-amine
CID 113455467
2-(3-methylfuran-2-yl)thieno[2,3-d]pyrimidin-4-amine
CID 104806532
6-cyclopropyl-5-iodo-2-(3-methylfuran-2-yl)pyrimidin-4-amine
CID 104806878
6-ethyl-5-methyl-2-pyridin-3-ylpyrimidin-4-amine
CID 63560551
6-ethyl-2-(4-ethylsulfanylphenyl)-5-methylpyrimidin-4-amine
CID 106849539
6-ethyl-2-(6-methoxypyridazin-3-yl)-5-methylpyrimidin-4-amine
CID 103375000
2-(3-bromothiophen-2-yl)-6-ethyl-5-methylpyrimidin-4-amine
CID 115381177
N-[[4,6-dimethyl-2-(3-methylfuran-2-yl)pyrimidin-5-yl]methyl]ethanamine
CID 113455509

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-5-methyl-2-(3-methylfuran-2-yl)pyrimidin-4-amine?
The IUPAC name of 6-ethyl-5-methyl-2-(3-methylfuran-2-yl)pyrimidin-4-amine (CID 104806721) is 6-ethyl-5-methyl-2-(3-methylfuran-2-yl)pyrimidin-4-amine.
What is the SMILES notation for 6-ethyl-5-methyl-2-(3-methylfuran-2-yl)pyrimidin-4-amine?
The canonical SMILES for 6-ethyl-5-methyl-2-(3-methylfuran-2-yl)pyrimidin-4-amine is CCc1nc(-c2occc2C)nc(N)c1C.
What is the InChIKey of 6-ethyl-5-methyl-2-(3-methylfuran-2-yl)pyrimidin-4-amine?
The InChIKey is MLNJHMIMKRPKIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O/c1-4-9-8(3)11(13)15-12(14-9)10-7(2)5-6-16-10/h5-6H,4H2,1-3H3,(H2,13,14,15).
What are the key properties of 6-ethyl-5-methyl-2-(3-methylfuran-2-yl)pyrimidin-4-amine?
6-ethyl-5-methyl-2-(3-methylfuran-2-yl)pyrimidin-4-amine has a molecular weight of 217.27 g/mol, XLogP of 2.50, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-5-methyl-2-(3-methylfuran-2-yl)pyrimidin-4-amine is sourced from PubChem (CID 104806721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).