4-methoxy-N,N-dimethylpyrimidin-5-amine

C7H11N3O — CID 173064596

IUPAC4-methoxy-N,N-dimethylpyrimidin-5-amine
SMILESCOc1ncncc1N(C)C
InChIInChI=1S/C7H11N3O/c1-10(2)6-4-8-5-9-7(6)11-3/h4-5H,1-3H3
InChIKeyMRIIIVBQABEXFU-UHFFFAOYSA-N
MW153.18 g/mol
LogP0.55
Rot. Bonds2

About 4-methoxy-N,N-dimethylpyrimidin-5-amine

4-methoxy-N,N-dimethylpyrimidin-5-amine (PubChem CID 173064596) has the molecular formula C7H11N3O and a molecular weight of 153.18 g/mol. Its IUPAC name is 4-methoxy-N,N-dimethylpyrimidin-5-amine.

Molecular Properties

Compound Name4-methoxy-N,N-dimethylpyrimidin-5-amine
PubChem CID173064596
Molecular FormulaC7H11N3O
Molecular Weight153.18 g/mol
Exact Mass153.09
IUPAC Name4-methoxy-N,N-dimethylpyrimidin-5-amine
SMILESCOc1ncncc1N(C)C
InChIInChI=1S/C7H11N3O/c1-10(2)6-4-8-5-9-7(6)11-3/h4-5H,1-3H3
InChIKeyMRIIIVBQABEXFU-UHFFFAOYSA-N
XLogP0.55
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.18
LogP ≤ 50.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N,N-dimethylpyrimidin-5-amine?
The IUPAC name of 4-methoxy-N,N-dimethylpyrimidin-5-amine (CID 173064596) is 4-methoxy-N,N-dimethylpyrimidin-5-amine.
What is the SMILES notation for 4-methoxy-N,N-dimethylpyrimidin-5-amine?
The canonical SMILES for 4-methoxy-N,N-dimethylpyrimidin-5-amine is COc1ncncc1N(C)C.
What is the InChIKey of 4-methoxy-N,N-dimethylpyrimidin-5-amine?
The InChIKey is MRIIIVBQABEXFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O/c1-10(2)6-4-8-5-9-7(6)11-3/h4-5H,1-3H3.
What are the key properties of 4-methoxy-N,N-dimethylpyrimidin-5-amine?
4-methoxy-N,N-dimethylpyrimidin-5-amine has a molecular weight of 153.18 g/mol, XLogP of 0.55, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N,N-dimethylpyrimidin-5-amine is sourced from PubChem (CID 173064596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).