4-(4-methoxy-3-propan-2-ylphenyl)-6-methylpyrimidin-5-amine

C15H19N3O — CID 82483013

IUPAC4-(4-methoxy-3-propan-2-ylphenyl)-6-methylpyrimidin-5-amine
SMILESCOc1ccc(-c2ncnc(C)c2N)cc1C(C)C
InChIInChI=1S/C15H19N3O/c1-9(2)12-7-11(5-6-13(12)19-4)15-14(16)10(3)17-8-18-15/h5-9H,16H2,1-4H3
InChIKeyHBSKGBOZAHKVAF-UHFFFAOYSA-N
MW257.34 g/mol
LogP3.17
Rot. Bonds3

About 4-(4-methoxy-3-propan-2-ylphenyl)-6-methylpyrimidin-5-amine

4-(4-methoxy-3-propan-2-ylphenyl)-6-methylpyrimidin-5-amine (PubChem CID 82483013) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is 4-(4-methoxy-3-propan-2-ylphenyl)-6-methylpyrimidin-5-amine.

Molecular Properties

Compound Name4-(4-methoxy-3-propan-2-ylphenyl)-6-methylpyrimidin-5-amine
PubChem CID82483013
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC Name4-(4-methoxy-3-propan-2-ylphenyl)-6-methylpyrimidin-5-amine
SMILESCOc1ccc(-c2ncnc(C)c2N)cc1C(C)C
InChIInChI=1S/C15H19N3O/c1-9(2)12-7-11(5-6-13(12)19-4)15-14(16)10(3)17-8-18-15/h5-9H,16H2,1-4H3
InChIKeyHBSKGBOZAHKVAF-UHFFFAOYSA-N
XLogP3.17
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(4-methoxy-3-propan-2-ylphenyl)-5-methyl-1H-pyrazol-4-amine
CID 82118332
4-(2-methoxy-5-methylphenyl)-6-methylpyrimidin-5-amine
CID 82391060
4-(4-methoxy-3-propan-2-ylphenyl)-6-methylpyrimidin-2-amine
CID 82300017
4-(5-fluoro-2-methoxyphenyl)-6-methylpyrimidin-5-amine
CID 82390103
2-[4-(4-methoxy-3-propan-2-ylphenyl)-2-methyl-1H-imidazol-5-yl]ethanamine
CID 95475739
6-(4-methoxy-3-propan-2-ylphenyl)pyrimidine-4-carbaldehyde
CID 116857718
5-(4-methoxy-3-propan-2-ylphenyl)-N-methylpyrimidin-2-amine
CID 116976965
4-(4-methoxy-3-propan-2-ylphenyl)-2-methyl-1,3-thiazole-5-carbaldehyde
CID 94699090
2-(4-methoxy-3-propan-2-ylphenyl)-4-methyl-1,3-thiazol-5-ol
CID 116886031
[5-(4-methoxy-3-propan-2-ylphenyl)-1-methylpyrazol-3-yl]methanamine
CID 82484172
5-(4-methoxy-3-propan-2-ylphenyl)-1H-imidazole
CID 82078805
[2-bromo-4-(4-methoxy-3-propan-2-ylphenyl)-1H-imidazol-5-yl]methanamine
CID 84605935

Frequently Asked Questions

What is the IUPAC name of 4-(4-methoxy-3-propan-2-ylphenyl)-6-methylpyrimidin-5-amine?
The IUPAC name of 4-(4-methoxy-3-propan-2-ylphenyl)-6-methylpyrimidin-5-amine (CID 82483013) is 4-(4-methoxy-3-propan-2-ylphenyl)-6-methylpyrimidin-5-amine.
What is the SMILES notation for 4-(4-methoxy-3-propan-2-ylphenyl)-6-methylpyrimidin-5-amine?
The canonical SMILES for 4-(4-methoxy-3-propan-2-ylphenyl)-6-methylpyrimidin-5-amine is COc1ccc(-c2ncnc(C)c2N)cc1C(C)C.
What is the InChIKey of 4-(4-methoxy-3-propan-2-ylphenyl)-6-methylpyrimidin-5-amine?
The InChIKey is HBSKGBOZAHKVAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-9(2)12-7-11(5-6-13(12)19-4)15-14(16)10(3)17-8-18-15/h5-9H,16H2,1-4H3.
What are the key properties of 4-(4-methoxy-3-propan-2-ylphenyl)-6-methylpyrimidin-5-amine?
4-(4-methoxy-3-propan-2-ylphenyl)-6-methylpyrimidin-5-amine has a molecular weight of 257.34 g/mol, XLogP of 3.17, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methoxy-3-propan-2-ylphenyl)-6-methylpyrimidin-5-amine is sourced from PubChem (CID 82483013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).