5-methoxy-N-methylpyrimidin-2-amine

C6H9N3O — CID 20636389

IUPAC5-methoxy-N-methylpyrimidin-2-amine
SMILESCNc1ncc(OC)cn1
InChIInChI=1S/C6H9N3O/c1-7-6-8-3-5(10-2)4-9-6/h3-4H,1-2H3,(H,7,8,9)
InChIKeyIXZXVQOMXSEEPO-UHFFFAOYSA-N
MW139.16 g/mol
LogP0.53
Rot. Bonds2

About 5-methoxy-N-methylpyrimidin-2-amine

5-methoxy-N-methylpyrimidin-2-amine (PubChem CID 20636389) has the molecular formula C6H9N3O and a molecular weight of 139.16 g/mol. Its IUPAC name is 5-methoxy-N-methylpyrimidin-2-amine.

Molecular Properties

Compound Name5-methoxy-N-methylpyrimidin-2-amine
PubChem CID20636389
Molecular FormulaC6H9N3O
Molecular Weight139.16 g/mol
Exact Mass139.07
IUPAC Name5-methoxy-N-methylpyrimidin-2-amine
SMILESCNc1ncc(OC)cn1
InChIInChI=1S/C6H9N3O/c1-7-6-8-3-5(10-2)4-9-6/h3-4H,1-2H3,(H,7,8,9)
InChIKeyIXZXVQOMXSEEPO-UHFFFAOYSA-N
XLogP0.53
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.16
LogP ≤ 50.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-methoxy-N-methylpyrimidin-2-amine?
The IUPAC name of 5-methoxy-N-methylpyrimidin-2-amine (CID 20636389) is 5-methoxy-N-methylpyrimidin-2-amine.
What is the SMILES notation for 5-methoxy-N-methylpyrimidin-2-amine?
The canonical SMILES for 5-methoxy-N-methylpyrimidin-2-amine is CNc1ncc(OC)cn1.
What is the InChIKey of 5-methoxy-N-methylpyrimidin-2-amine?
The InChIKey is IXZXVQOMXSEEPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3O/c1-7-6-8-3-5(10-2)4-9-6/h3-4H,1-2H3,(H,7,8,9).
What are the key properties of 5-methoxy-N-methylpyrimidin-2-amine?
5-methoxy-N-methylpyrimidin-2-amine has a molecular weight of 139.16 g/mol, XLogP of 0.53, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-N-methylpyrimidin-2-amine is sourced from PubChem (CID 20636389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).