5-(2-aminoethyl)-N,N-dimethylpyrimidin-2-amine

C8H14N4 — CID 62756266

IUPAC5-(2-aminoethyl)-N,N-dimethylpyrimidin-2-amine
SMILESCN(C)c1ncc(CCN)cn1
InChIInChI=1S/C8H14N4/c1-12(2)8-10-5-7(3-4-9)6-11-8/h5-6H,3-4,9H2,1-2H3
InChIKeyILPHCRZFMBJHEW-UHFFFAOYSA-N
MW166.23 g/mol
LogP0.04
Rot. Bonds3

About 5-(2-aminoethyl)-N,N-dimethylpyrimidin-2-amine

5-(2-aminoethyl)-N,N-dimethylpyrimidin-2-amine (PubChem CID 62756266) has the molecular formula C8H14N4 and a molecular weight of 166.23 g/mol. Its IUPAC name is 5-(2-aminoethyl)-N,N-dimethylpyrimidin-2-amine.

Molecular Properties

Compound Name5-(2-aminoethyl)-N,N-dimethylpyrimidin-2-amine
PubChem CID62756266
Molecular FormulaC8H14N4
Molecular Weight166.23 g/mol
Exact Mass166.12
IUPAC Name5-(2-aminoethyl)-N,N-dimethylpyrimidin-2-amine
SMILESCN(C)c1ncc(CCN)cn1
InChIInChI=1S/C8H14N4/c1-12(2)8-10-5-7(3-4-9)6-11-8/h5-6H,3-4,9H2,1-2H3
InChIKeyILPHCRZFMBJHEW-UHFFFAOYSA-N
XLogP0.04
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.23
LogP ≤ 50.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(2-aminoethyl)-N,N-dimethylpyrimidin-2-amine?
The IUPAC name of 5-(2-aminoethyl)-N,N-dimethylpyrimidin-2-amine (CID 62756266) is 5-(2-aminoethyl)-N,N-dimethylpyrimidin-2-amine.
What is the SMILES notation for 5-(2-aminoethyl)-N,N-dimethylpyrimidin-2-amine?
The canonical SMILES for 5-(2-aminoethyl)-N,N-dimethylpyrimidin-2-amine is CN(C)c1ncc(CCN)cn1.
What is the InChIKey of 5-(2-aminoethyl)-N,N-dimethylpyrimidin-2-amine?
The InChIKey is ILPHCRZFMBJHEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N4/c1-12(2)8-10-5-7(3-4-9)6-11-8/h5-6H,3-4,9H2,1-2H3.
What are the key properties of 5-(2-aminoethyl)-N,N-dimethylpyrimidin-2-amine?
5-(2-aminoethyl)-N,N-dimethylpyrimidin-2-amine has a molecular weight of 166.23 g/mol, XLogP of 0.04, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-aminoethyl)-N,N-dimethylpyrimidin-2-amine is sourced from PubChem (CID 62756266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).