2-cyclopropyl-6-(2-methoxy-3,4-dimethylphenyl)-5-methylpyrimidin-4-amine

C17H21N3O — CID 103434518

IUPAC2-cyclopropyl-6-(2-methoxy-3,4-dimethylphenyl)-5-methylpyrimidin-4-amine
SMILESCOc1c(-c2nc(C3CC3)nc(N)c2C)ccc(C)c1C
InChIInChI=1S/C17H21N3O/c1-9-5-8-13(15(21-4)10(9)2)14-11(3)16(18)20-17(19-14)12-6-7-12/h5,8,12H,6-7H2,1-4H3,(H2,18,19,20)
InChIKeyPEYKXTUHQOMVHJ-UHFFFAOYSA-N
MW283.38 g/mol
LogP3.54
Rot. Bonds3

About 2-cyclopropyl-6-(2-methoxy-3,4-dimethylphenyl)-5-methylpyrimidin-4-amine

2-cyclopropyl-6-(2-methoxy-3,4-dimethylphenyl)-5-methylpyrimidin-4-amine (PubChem CID 103434518) has the molecular formula C17H21N3O and a molecular weight of 283.38 g/mol. Its IUPAC name is 2-cyclopropyl-6-(2-methoxy-3,4-dimethylphenyl)-5-methylpyrimidin-4-amine.

Molecular Properties

Compound Name2-cyclopropyl-6-(2-methoxy-3,4-dimethylphenyl)-5-methylpyrimidin-4-amine
PubChem CID103434518
Molecular FormulaC17H21N3O
Molecular Weight283.38 g/mol
Exact Mass283.17
IUPAC Name2-cyclopropyl-6-(2-methoxy-3,4-dimethylphenyl)-5-methylpyrimidin-4-amine
SMILESCOc1c(-c2nc(C3CC3)nc(N)c2C)ccc(C)c1C
InChIInChI=1S/C17H21N3O/c1-9-5-8-13(15(21-4)10(9)2)14-11(3)16(18)20-17(19-14)12-6-7-12/h5,8,12H,6-7H2,1-4H3,(H2,18,19,20)
InChIKeyPEYKXTUHQOMVHJ-UHFFFAOYSA-N
XLogP3.54
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.38
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-cyclopropyl-6-(furan-2-yl)-5-methylpyrimidin-4-amine
CID 80977406
6-(2-chlorophenyl)-2-cyclopropyl-5-methylpyrimidin-4-amine
CID 80975338
3-(6-amino-2-cyclopropyl-5-methylpyrimidin-4-yl)-4-methoxybenzonitrile
CID 106951542
2-cyclopropyl-6-(3,4-dichlorophenyl)-5-methylpyrimidin-4-amine
CID 80975439
2-cyclopropyl-5-methyl-6-thiophen-2-ylpyrimidin-4-amine
CID 80975062
4-(2-methoxy-3,4-dimethylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-6-amine
CID 103434577
2-cyclopropyl-6-(2,5-dimethylphenoxy)-5-methylpyrimidin-4-amine
CID 80988869
2-(2-methoxy-3,4-dimethylphenyl)pyridin-4-amine
CID 103434063
4-(2-methoxy-3,4-dimethylphenyl)-3-methylaniline
CID 103434076
4-chloro-5-methoxy-6-(2-methoxy-3,4-dimethylphenyl)pyrimidine
CID 103434429
6-(4-chloro-3-methylphenoxy)-2-cyclopropyl-5-methylpyrimidin-4-amine
CID 80989341
2-cyclopropyl-4-N-(3,4-dimethylphenyl)-5-methylpyrimidine-4,6-diamine
CID 80975985

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-6-(2-methoxy-3,4-dimethylphenyl)-5-methylpyrimidin-4-amine?
The IUPAC name of 2-cyclopropyl-6-(2-methoxy-3,4-dimethylphenyl)-5-methylpyrimidin-4-amine (CID 103434518) is 2-cyclopropyl-6-(2-methoxy-3,4-dimethylphenyl)-5-methylpyrimidin-4-amine.
What is the SMILES notation for 2-cyclopropyl-6-(2-methoxy-3,4-dimethylphenyl)-5-methylpyrimidin-4-amine?
The canonical SMILES for 2-cyclopropyl-6-(2-methoxy-3,4-dimethylphenyl)-5-methylpyrimidin-4-amine is COc1c(-c2nc(C3CC3)nc(N)c2C)ccc(C)c1C.
What is the InChIKey of 2-cyclopropyl-6-(2-methoxy-3,4-dimethylphenyl)-5-methylpyrimidin-4-amine?
The InChIKey is PEYKXTUHQOMVHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O/c1-9-5-8-13(15(21-4)10(9)2)14-11(3)16(18)20-17(19-14)12-6-7-12/h5,8,12H,6-7H2,1-4H3,(H2,18,19,20).
What are the key properties of 2-cyclopropyl-6-(2-methoxy-3,4-dimethylphenyl)-5-methylpyrimidin-4-amine?
2-cyclopropyl-6-(2-methoxy-3,4-dimethylphenyl)-5-methylpyrimidin-4-amine has a molecular weight of 283.38 g/mol, XLogP of 3.54, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-6-(2-methoxy-3,4-dimethylphenyl)-5-methylpyrimidin-4-amine is sourced from PubChem (CID 103434518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).