2-(2,5-dimethylphenyl)-N-methyl-1-pyrimidin-4-ylethanamine

C15H19N3 — CID 63989159

IUPAC2-(2,5-dimethylphenyl)-N-methyl-1-pyrimidin-4-ylethanamine
SMILESCNC(Cc1cc(C)ccc1C)c1ccncn1
InChIInChI=1S/C15H19N3/c1-11-4-5-12(2)13(8-11)9-15(16-3)14-6-7-17-10-18-14/h4-8,10,15-16H,9H2,1-3H3
InChIKeyLDKNZYSSRSQQEJ-UHFFFAOYSA-N
MW241.34 g/mol
LogP2.60
Rot. Bonds4

About 2-(2,5-dimethylphenyl)-N-methyl-1-pyrimidin-4-ylethanamine

2-(2,5-dimethylphenyl)-N-methyl-1-pyrimidin-4-ylethanamine (PubChem CID 63989159) has the molecular formula C15H19N3 and a molecular weight of 241.34 g/mol. Its IUPAC name is 2-(2,5-dimethylphenyl)-N-methyl-1-pyrimidin-4-ylethanamine.

Molecular Properties

Compound Name2-(2,5-dimethylphenyl)-N-methyl-1-pyrimidin-4-ylethanamine
PubChem CID63989159
Molecular FormulaC15H19N3
Molecular Weight241.34 g/mol
Exact Mass241.16
IUPAC Name2-(2,5-dimethylphenyl)-N-methyl-1-pyrimidin-4-ylethanamine
SMILESCNC(Cc1cc(C)ccc1C)c1ccncn1
InChIInChI=1S/C15H19N3/c1-11-4-5-12(2)13(8-11)9-15(16-3)14-6-7-17-10-18-14/h4-8,10,15-16H,9H2,1-3H3
InChIKeyLDKNZYSSRSQQEJ-UHFFFAOYSA-N
XLogP2.60
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.34
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(2-methoxy-5-methylphenyl)-1-pyrimidin-4-ylethyl]propan-1-amine
CID 63989184
[2-(2-chloro-4-methylphenyl)-1-pyrimidin-4-ylethyl]hydrazine
CID 106871397
1-(2,4-dimethylphenyl)-2-(2,5-dimethylphenyl)-N-methylethanamine
CID 63508884
2-(2,5-dimethylphenyl)-1-(1,5-dimethylpyrazol-4-yl)-N-methylethanamine
CID 105100937
[2-(2-methylphenyl)-1-pyrimidin-4-ylethyl]hydrazine
CID 105221007
2-(5-bromo-2-methoxyphenyl)-N-methyl-1-pyrimidin-4-ylethanamine
CID 63987280
N-[2-(3,5-dimethylphenyl)-1-pyrimidin-4-ylethyl]propan-1-amine
CID 63990004
2-(2,5-dimethylphenyl)-1-(4-fluoro-3,5-dimethylphenyl)-N-methylethanamine
CID 65298907
1-(3,5-dichlorophenyl)-2-(2,5-dimethylphenyl)-N-methylethanamine
CID 63526772
2-(furan-2-yl)-N-methyl-1-pyrimidin-4-ylethanamine
CID 83175333
2-(2,5-dimethylphenyl)-1-(5-methoxy-3-pyridinyl)-N-methylethanamine
CID 105026038
N-methyl-1-pyrimidin-4-ylpent-4-yn-1-amine
CID 63988752

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethylphenyl)-N-methyl-1-pyrimidin-4-ylethanamine?
The IUPAC name of 2-(2,5-dimethylphenyl)-N-methyl-1-pyrimidin-4-ylethanamine (CID 63989159) is 2-(2,5-dimethylphenyl)-N-methyl-1-pyrimidin-4-ylethanamine.
What is the SMILES notation for 2-(2,5-dimethylphenyl)-N-methyl-1-pyrimidin-4-ylethanamine?
The canonical SMILES for 2-(2,5-dimethylphenyl)-N-methyl-1-pyrimidin-4-ylethanamine is CNC(Cc1cc(C)ccc1C)c1ccncn1.
What is the InChIKey of 2-(2,5-dimethylphenyl)-N-methyl-1-pyrimidin-4-ylethanamine?
The InChIKey is LDKNZYSSRSQQEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3/c1-11-4-5-12(2)13(8-11)9-15(16-3)14-6-7-17-10-18-14/h4-8,10,15-16H,9H2,1-3H3.
What are the key properties of 2-(2,5-dimethylphenyl)-N-methyl-1-pyrimidin-4-ylethanamine?
2-(2,5-dimethylphenyl)-N-methyl-1-pyrimidin-4-ylethanamine has a molecular weight of 241.34 g/mol, XLogP of 2.60, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethylphenyl)-N-methyl-1-pyrimidin-4-ylethanamine is sourced from PubChem (CID 63989159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).