6-(methoxymethyl)-N,N-dimethylpyrimidin-4-amine

C8H13N3O — CID 14306176

IUPAC6-(methoxymethyl)-N,N-dimethylpyrimidin-4-amine
SMILESCOCc1cc(N(C)C)ncn1
InChIInChI=1S/C8H13N3O/c1-11(2)8-4-7(5-12-3)9-6-10-8/h4,6H,5H2,1-3H3
InChIKeyXAAULAIBAODDGK-UHFFFAOYSA-N
MW167.21 g/mol
LogP0.69
Rot. Bonds3

About 6-(methoxymethyl)-N,N-dimethylpyrimidin-4-amine

6-(methoxymethyl)-N,N-dimethylpyrimidin-4-amine (PubChem CID 14306176) has the molecular formula C8H13N3O and a molecular weight of 167.21 g/mol. Its IUPAC name is 6-(methoxymethyl)-N,N-dimethylpyrimidin-4-amine.

Molecular Properties

Compound Name6-(methoxymethyl)-N,N-dimethylpyrimidin-4-amine
PubChem CID14306176
Molecular FormulaC8H13N3O
Molecular Weight167.21 g/mol
Exact Mass167.11
IUPAC Name6-(methoxymethyl)-N,N-dimethylpyrimidin-4-amine
SMILESCOCc1cc(N(C)C)ncn1
InChIInChI=1S/C8H13N3O/c1-11(2)8-4-7(5-12-3)9-6-10-8/h4,6H,5H2,1-3H3
InChIKeyXAAULAIBAODDGK-UHFFFAOYSA-N
XLogP0.69
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.21
LogP ≤ 50.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 62320865
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Frequently Asked Questions

What is the IUPAC name of 6-(methoxymethyl)-N,N-dimethylpyrimidin-4-amine?
The IUPAC name of 6-(methoxymethyl)-N,N-dimethylpyrimidin-4-amine (CID 14306176) is 6-(methoxymethyl)-N,N-dimethylpyrimidin-4-amine.
What is the SMILES notation for 6-(methoxymethyl)-N,N-dimethylpyrimidin-4-amine?
The canonical SMILES for 6-(methoxymethyl)-N,N-dimethylpyrimidin-4-amine is COCc1cc(N(C)C)ncn1.
What is the InChIKey of 6-(methoxymethyl)-N,N-dimethylpyrimidin-4-amine?
The InChIKey is XAAULAIBAODDGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3O/c1-11(2)8-4-7(5-12-3)9-6-10-8/h4,6H,5H2,1-3H3.
What are the key properties of 6-(methoxymethyl)-N,N-dimethylpyrimidin-4-amine?
6-(methoxymethyl)-N,N-dimethylpyrimidin-4-amine has a molecular weight of 167.21 g/mol, XLogP of 0.69, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(methoxymethyl)-N,N-dimethylpyrimidin-4-amine is sourced from PubChem (CID 14306176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).