N,N-dimethylpyrimidin-4-amine

C6H9N3 — CID 579196

IUPACN,N-dimethylpyrimidin-4-amine
SMILESCN(C)c1ccncn1
InChIInChI=1S/C6H9N3/c1-9(2)6-3-4-7-5-8-6/h3-5H,1-2H3
InChIKeyMSXIOWULDXZJLX-UHFFFAOYSA-N
MW123.16 g/mol
LogP0.54
Rot. Bonds1

About N,N-dimethylpyrimidin-4-amine

N,N-dimethylpyrimidin-4-amine (PubChem CID 579196) has the molecular formula C6H9N3 and a molecular weight of 123.16 g/mol. Its IUPAC name is N,N-dimethylpyrimidin-4-amine.

Molecular Properties

Compound NameN,N-dimethylpyrimidin-4-amine
PubChem CID579196
Molecular FormulaC6H9N3
Molecular Weight123.16 g/mol
Exact Mass123.08
IUPAC NameN,N-dimethylpyrimidin-4-amine
SMILESCN(C)c1ccncn1
InChIInChI=1S/C6H9N3/c1-9(2)6-3-4-7-5-8-6/h3-5H,1-2H3
InChIKeyMSXIOWULDXZJLX-UHFFFAOYSA-N
XLogP0.54
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500123.16
LogP ≤ 50.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethylpyrimidin-4-amine?
The IUPAC name of N,N-dimethylpyrimidin-4-amine (CID 579196) is N,N-dimethylpyrimidin-4-amine.
What is the SMILES notation for N,N-dimethylpyrimidin-4-amine?
The canonical SMILES for N,N-dimethylpyrimidin-4-amine is CN(C)c1ccncn1.
What is the InChIKey of N,N-dimethylpyrimidin-4-amine?
The InChIKey is MSXIOWULDXZJLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3/c1-9(2)6-3-4-7-5-8-6/h3-5H,1-2H3.
What are the key properties of N,N-dimethylpyrimidin-4-amine?
N,N-dimethylpyrimidin-4-amine has a molecular weight of 123.16 g/mol, XLogP of 0.54, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethylpyrimidin-4-amine is sourced from PubChem (CID 579196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).