N-[(2,4,6-trimethylpyrimidin-5-yl)methyl]ethanamine

C10H17N3 — CID 62745483

IUPACN-[(2,4,6-trimethylpyrimidin-5-yl)methyl]ethanamine
SMILESCCNCc1c(C)nc(C)nc1C
InChIInChI=1S/C10H17N3/c1-5-11-6-10-7(2)12-9(4)13-8(10)3/h11H,5-6H2,1-4H3
InChIKeyJRQZKWFGZLDUFD-UHFFFAOYSA-N
MW179.27 g/mol
LogP1.51
Rot. Bonds3

About N-[(2,4,6-trimethylpyrimidin-5-yl)methyl]ethanamine

N-[(2,4,6-trimethylpyrimidin-5-yl)methyl]ethanamine (PubChem CID 62745483) has the molecular formula C10H17N3 and a molecular weight of 179.27 g/mol. Its IUPAC name is N-[(2,4,6-trimethylpyrimidin-5-yl)methyl]ethanamine.

Molecular Properties

Compound NameN-[(2,4,6-trimethylpyrimidin-5-yl)methyl]ethanamine
PubChem CID62745483
Molecular FormulaC10H17N3
Molecular Weight179.27 g/mol
Exact Mass179.14
IUPAC NameN-[(2,4,6-trimethylpyrimidin-5-yl)methyl]ethanamine
SMILESCCNCc1c(C)nc(C)nc1C
InChIInChI=1S/C10H17N3/c1-5-11-6-10-7(2)12-9(4)13-8(10)3/h11H,5-6H2,1-4H3
InChIKeyJRQZKWFGZLDUFD-UHFFFAOYSA-N
XLogP1.51
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.27
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(2,4,6-trimethylpyrimidin-5-yl)methyl]ethanamine?
The IUPAC name of N-[(2,4,6-trimethylpyrimidin-5-yl)methyl]ethanamine (CID 62745483) is N-[(2,4,6-trimethylpyrimidin-5-yl)methyl]ethanamine.
What is the SMILES notation for N-[(2,4,6-trimethylpyrimidin-5-yl)methyl]ethanamine?
The canonical SMILES for N-[(2,4,6-trimethylpyrimidin-5-yl)methyl]ethanamine is CCNCc1c(C)nc(C)nc1C.
What is the InChIKey of N-[(2,4,6-trimethylpyrimidin-5-yl)methyl]ethanamine?
The InChIKey is JRQZKWFGZLDUFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3/c1-5-11-6-10-7(2)12-9(4)13-8(10)3/h11H,5-6H2,1-4H3.
What are the key properties of N-[(2,4,6-trimethylpyrimidin-5-yl)methyl]ethanamine?
N-[(2,4,6-trimethylpyrimidin-5-yl)methyl]ethanamine has a molecular weight of 179.27 g/mol, XLogP of 1.51, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,4,6-trimethylpyrimidin-5-yl)methyl]ethanamine is sourced from PubChem (CID 62745483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).