N-methyl-4-(2,4,6-trimethylphenyl)pyrimidin-2-amine

C14H17N3 — CID 63550138

IUPACN-methyl-4-(2,4,6-trimethylphenyl)pyrimidin-2-amine
SMILESCNc1nccc(-c2c(C)cc(C)cc2C)n1
InChIInChI=1S/C14H17N3/c1-9-7-10(2)13(11(3)8-9)12-5-6-16-14(15-4)17-12/h5-8H,1-4H3,(H,15,16,17)
InChIKeyRCGOHPONRBNAOX-UHFFFAOYSA-N
MW227.31 g/mol
LogP3.11
Rot. Bonds2

About N-methyl-4-(2,4,6-trimethylphenyl)pyrimidin-2-amine

N-methyl-4-(2,4,6-trimethylphenyl)pyrimidin-2-amine (PubChem CID 63550138) has the molecular formula C14H17N3 and a molecular weight of 227.31 g/mol. Its IUPAC name is N-methyl-4-(2,4,6-trimethylphenyl)pyrimidin-2-amine.

Molecular Properties

Compound NameN-methyl-4-(2,4,6-trimethylphenyl)pyrimidin-2-amine
PubChem CID63550138
Molecular FormulaC14H17N3
Molecular Weight227.31 g/mol
Exact Mass227.14
IUPAC NameN-methyl-4-(2,4,6-trimethylphenyl)pyrimidin-2-amine
SMILESCNc1nccc(-c2c(C)cc(C)cc2C)n1
InChIInChI=1S/C14H17N3/c1-9-7-10(2)13(11(3)8-9)12-5-6-16-14(15-4)17-12/h5-8H,1-4H3,(H,15,16,17)
InChIKeyRCGOHPONRBNAOX-UHFFFAOYSA-N
XLogP3.11
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(2,6-difluoro-3-methylphenyl)-N-methylpyrimidin-2-amine
CID 82822591
4-(2,6-difluorophenyl)-N-methylpyrimidin-2-amine
CID 63550141
4-(2-chloro-5-fluoro-4-methylphenyl)-N-methylpyrimidin-2-amine
CID 116900585
N-methyl-4-(1,3,5-trimethylpyrazol-4-yl)pyrimidin-2-amine
CID 63547720
N-methyl-6-(2,4,6-trimethylphenyl)pyridin-2-amine
CID 115503483
2-methyl-2-[4-(2,4,6-trimethylphenyl)pyrimidin-2-yl]propan-1-amine
CID 116897983
2-[4-(2,4,6-trimethylphenyl)pyrimidin-2-yl]propan-2-ol
CID 116902051
2-(2-chloroethyl)-4-(2,4,6-trimethylphenyl)pyrimidine
CID 116899345
4-(6-methoxynaphthalen-2-yl)-N-methylpyrimidin-2-amine
CID 116900581
N-methyl-5-(2,4,6-trimethylphenyl)pyrimidin-2-amine
CID 116976971
2-chloro-4-(2-methoxy-4,6-dimethylphenyl)pyrimidine
CID 106681385
4-methyl-5-[2-(methylamino)pyrimidin-4-yl]-1,3-thiazol-2-amine
CID 155315773

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-(2,4,6-trimethylphenyl)pyrimidin-2-amine?
The IUPAC name of N-methyl-4-(2,4,6-trimethylphenyl)pyrimidin-2-amine (CID 63550138) is N-methyl-4-(2,4,6-trimethylphenyl)pyrimidin-2-amine.
What is the SMILES notation for N-methyl-4-(2,4,6-trimethylphenyl)pyrimidin-2-amine?
The canonical SMILES for N-methyl-4-(2,4,6-trimethylphenyl)pyrimidin-2-amine is CNc1nccc(-c2c(C)cc(C)cc2C)n1.
What is the InChIKey of N-methyl-4-(2,4,6-trimethylphenyl)pyrimidin-2-amine?
The InChIKey is RCGOHPONRBNAOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3/c1-9-7-10(2)13(11(3)8-9)12-5-6-16-14(15-4)17-12/h5-8H,1-4H3,(H,15,16,17).
What are the key properties of N-methyl-4-(2,4,6-trimethylphenyl)pyrimidin-2-amine?
N-methyl-4-(2,4,6-trimethylphenyl)pyrimidin-2-amine has a molecular weight of 227.31 g/mol, XLogP of 3.11, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-(2,4,6-trimethylphenyl)pyrimidin-2-amine is sourced from PubChem (CID 63550138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).