2-ethenyl-N,N-dimethylpyrimidin-4-amine

C8H11N3 — CID 176680804

IUPAC2-ethenyl-N,N-dimethylpyrimidin-4-amine
SMILESC=Cc1nccc(N(C)C)n1
InChIInChI=1S/C8H11N3/c1-4-7-9-6-5-8(10-7)11(2)3/h4-6H,1H2,2-3H3
InChIKeyJGZBFRWLDANRGW-UHFFFAOYSA-N
MW149.20 g/mol
LogP1.19
Rot. Bonds2

About 2-ethenyl-N,N-dimethylpyrimidin-4-amine

2-ethenyl-N,N-dimethylpyrimidin-4-amine (PubChem CID 176680804) has the molecular formula C8H11N3 and a molecular weight of 149.20 g/mol. Its IUPAC name is 2-ethenyl-N,N-dimethylpyrimidin-4-amine.

Molecular Properties

Compound Name2-ethenyl-N,N-dimethylpyrimidin-4-amine
PubChem CID176680804
Molecular FormulaC8H11N3
Molecular Weight149.20 g/mol
Exact Mass149.10
IUPAC Name2-ethenyl-N,N-dimethylpyrimidin-4-amine
SMILESC=Cc1nccc(N(C)C)n1
InChIInChI=1S/C8H11N3/c1-4-7-9-6-5-8(10-7)11(2)3/h4-6H,1H2,2-3H3
InChIKeyJGZBFRWLDANRGW-UHFFFAOYSA-N
XLogP1.19
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.20
LogP ≤ 51.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-ethenyl-N,N-dimethylpyrimidin-4-amine?
The IUPAC name of 2-ethenyl-N,N-dimethylpyrimidin-4-amine (CID 176680804) is 2-ethenyl-N,N-dimethylpyrimidin-4-amine.
What is the SMILES notation for 2-ethenyl-N,N-dimethylpyrimidin-4-amine?
The canonical SMILES for 2-ethenyl-N,N-dimethylpyrimidin-4-amine is C=Cc1nccc(N(C)C)n1.
What is the InChIKey of 2-ethenyl-N,N-dimethylpyrimidin-4-amine?
The InChIKey is JGZBFRWLDANRGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3/c1-4-7-9-6-5-8(10-7)11(2)3/h4-6H,1H2,2-3H3.
What are the key properties of 2-ethenyl-N,N-dimethylpyrimidin-4-amine?
2-ethenyl-N,N-dimethylpyrimidin-4-amine has a molecular weight of 149.20 g/mol, XLogP of 1.19, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethenyl-N,N-dimethylpyrimidin-4-amine is sourced from PubChem (CID 176680804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).