4-methyl-N-(2-methylphenyl)-6-morpholin-4-ylpyrimidin-2-amine

C16H20N4O — CID 112912131

IUPAC4-methyl-N-(2-methylphenyl)-6-morpholin-4-ylpyrimidin-2-amine
SMILESCc1cc(N2CCOCC2)nc(Nc2ccccc2C)n1
InChIInChI=1S/C16H20N4O/c1-12-5-3-4-6-14(12)18-16-17-13(2)11-15(19-16)20-7-9-21-10-8-20/h3-6,11H,7-10H2,1-2H3,(H,17,18,19)
InChIKeyZCMYJVABPDWOFW-UHFFFAOYSA-N
MW284.36 g/mol
LogP2.67
Rot. Bonds3

About 4-methyl-N-(2-methylphenyl)-6-morpholin-4-ylpyrimidin-2-amine

4-methyl-N-(2-methylphenyl)-6-morpholin-4-ylpyrimidin-2-amine (PubChem CID 112912131) has the molecular formula C16H20N4O and a molecular weight of 284.36 g/mol. Its IUPAC name is 4-methyl-N-(2-methylphenyl)-6-morpholin-4-ylpyrimidin-2-amine.

Molecular Properties

Compound Name4-methyl-N-(2-methylphenyl)-6-morpholin-4-ylpyrimidin-2-amine
PubChem CID112912131
Molecular FormulaC16H20N4O
Molecular Weight284.36 g/mol
Exact Mass284.16
IUPAC Name4-methyl-N-(2-methylphenyl)-6-morpholin-4-ylpyrimidin-2-amine
SMILESCc1cc(N2CCOCC2)nc(Nc2ccccc2C)n1
InChIInChI=1S/C16H20N4O/c1-12-5-3-4-6-14(12)18-16-17-13(2)11-15(19-16)20-7-9-21-10-8-20/h3-6,11H,7-10H2,1-2H3,(H,17,18,19)
InChIKeyZCMYJVABPDWOFW-UHFFFAOYSA-N
XLogP2.67
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-methyl-N-(2-morpholin-4-ylphenyl)-6-pyrrolidin-1-ylpyrimidin-2-amine
CID 112909374
4-[6-methyl-2-(2-methylanilino)pyrimidin-4-yl]piperazine-1-carbaldehyde
CID 112914538
N-(2,4-dimethoxyphenyl)-4-methyl-6-morpholin-4-ylpyrimidin-2-amine
CID 112912177
4-chloro-N-(2-methylphenyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 748919
4-(azepan-1-yl)-N-(2,6-dimethylphenyl)-6-methylpyrimidin-2-amine
CID 112926580
2-N-(2,4-dimethylphenyl)-6-methyl-4-N-(2-morpholin-4-ylphenyl)pyrimidine-2,4-diamine
CID 112928044
N-(2,5-dimethylphenyl)-4-methyl-6-pyrrolidin-1-ylpyrimidin-2-amine
CID 112909317
N-(2-chlorophenyl)-4-methyl-6-(4-methylpiperazin-1-yl)pyrimidin-2-amine
CID 112913869
4-[2-(2-fluoroanilino)-6-methylpyrimidin-4-yl]piperazine-1-carbaldehyde
CID 112914561
2-[[4-methyl-6-(4-phenylpiperazin-1-yl)pyrimidin-2-yl]amino]benzonitrile
CID 112922226
N-(2,5-dimethylphenyl)-4-methyl-6-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-2-amine
CID 112923847
N-(4-chloro-2-methylphenyl)-4-methyl-6-pyrrolidin-1-ylpyrimidin-2-amine
CID 112909339

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(2-methylphenyl)-6-morpholin-4-ylpyrimidin-2-amine?
The IUPAC name of 4-methyl-N-(2-methylphenyl)-6-morpholin-4-ylpyrimidin-2-amine (CID 112912131) is 4-methyl-N-(2-methylphenyl)-6-morpholin-4-ylpyrimidin-2-amine.
What is the SMILES notation for 4-methyl-N-(2-methylphenyl)-6-morpholin-4-ylpyrimidin-2-amine?
The canonical SMILES for 4-methyl-N-(2-methylphenyl)-6-morpholin-4-ylpyrimidin-2-amine is Cc1cc(N2CCOCC2)nc(Nc2ccccc2C)n1.
What is the InChIKey of 4-methyl-N-(2-methylphenyl)-6-morpholin-4-ylpyrimidin-2-amine?
The InChIKey is ZCMYJVABPDWOFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O/c1-12-5-3-4-6-14(12)18-16-17-13(2)11-15(19-16)20-7-9-21-10-8-20/h3-6,11H,7-10H2,1-2H3,(H,17,18,19).
What are the key properties of 4-methyl-N-(2-methylphenyl)-6-morpholin-4-ylpyrimidin-2-amine?
4-methyl-N-(2-methylphenyl)-6-morpholin-4-ylpyrimidin-2-amine has a molecular weight of 284.36 g/mol, XLogP of 2.67, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(2-methylphenyl)-6-morpholin-4-ylpyrimidin-2-amine is sourced from PubChem (CID 112912131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).