6-(4-aminopyrimidin-5-yl)-N-methylpyrimidin-4-amine

C9H10N6 — CID 71170671

IUPAC6-(4-aminopyrimidin-5-yl)-N-methylpyrimidin-4-amine
SMILESCNc1cc(-c2cncnc2N)ncn1
InChIInChI=1S/C9H10N6/c1-11-8-2-7(13-5-14-8)6-3-12-4-15-9(6)10/h2-5H,1H3,(H2,10,12,15)(H,11,13,14)
InChIKeyWEBYXGHMIDSFBM-UHFFFAOYSA-N
MW202.22 g/mol
LogP0.56
Rot. Bonds2

About 6-(4-aminopyrimidin-5-yl)-N-methylpyrimidin-4-amine

6-(4-aminopyrimidin-5-yl)-N-methylpyrimidin-4-amine (PubChem CID 71170671) has the molecular formula C9H10N6 and a molecular weight of 202.22 g/mol. Its IUPAC name is 6-(4-aminopyrimidin-5-yl)-N-methylpyrimidin-4-amine.

Molecular Properties

Compound Name6-(4-aminopyrimidin-5-yl)-N-methylpyrimidin-4-amine
PubChem CID71170671
Molecular FormulaC9H10N6
Molecular Weight202.22 g/mol
Exact Mass202.10
IUPAC Name6-(4-aminopyrimidin-5-yl)-N-methylpyrimidin-4-amine
SMILESCNc1cc(-c2cncnc2N)ncn1
InChIInChI=1S/C9H10N6/c1-11-8-2-7(13-5-14-8)6-3-12-4-15-9(6)10/h2-5H,1H3,(H2,10,12,15)(H,11,13,14)
InChIKeyWEBYXGHMIDSFBM-UHFFFAOYSA-N
XLogP0.56
TPSA89.61 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.22
LogP ≤ 50.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-(4-aminopyrimidin-5-yl)-N-methylpyrimidin-4-amine?
The IUPAC name of 6-(4-aminopyrimidin-5-yl)-N-methylpyrimidin-4-amine (CID 71170671) is 6-(4-aminopyrimidin-5-yl)-N-methylpyrimidin-4-amine.
What is the SMILES notation for 6-(4-aminopyrimidin-5-yl)-N-methylpyrimidin-4-amine?
The canonical SMILES for 6-(4-aminopyrimidin-5-yl)-N-methylpyrimidin-4-amine is CNc1cc(-c2cncnc2N)ncn1.
What is the InChIKey of 6-(4-aminopyrimidin-5-yl)-N-methylpyrimidin-4-amine?
The InChIKey is WEBYXGHMIDSFBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N6/c1-11-8-2-7(13-5-14-8)6-3-12-4-15-9(6)10/h2-5H,1H3,(H2,10,12,15)(H,11,13,14).
What are the key properties of 6-(4-aminopyrimidin-5-yl)-N-methylpyrimidin-4-amine?
6-(4-aminopyrimidin-5-yl)-N-methylpyrimidin-4-amine has a molecular weight of 202.22 g/mol, XLogP of 0.56, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-aminopyrimidin-5-yl)-N-methylpyrimidin-4-amine is sourced from PubChem (CID 71170671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).