2-methyl-5-methylidene-4H-pyrimidin-6-amine

C6H9N3 — CID 54069243

IUPAC2-methyl-5-methylidene-4H-pyrimidin-6-amine
SMILESC=C1CN=C(C)N=C1N
InChIInChI=1S/C6H9N3/c1-4-3-8-5(2)9-6(4)7/h1,3H2,2H3,(H2,7,8,9)
InChIKeyFHUXUXBAJYXYRF-UHFFFAOYSA-N
MW123.16 g/mol
LogP0.33
Rot. Bonds

About 2-methyl-5-methylidene-4H-pyrimidin-6-amine

2-methyl-5-methylidene-4H-pyrimidin-6-amine (PubChem CID 54069243) has the molecular formula C6H9N3 and a molecular weight of 123.16 g/mol. Its IUPAC name is 2-methyl-5-methylidene-4H-pyrimidin-6-amine.

Molecular Properties

Compound Name2-methyl-5-methylidene-4H-pyrimidin-6-amine
PubChem CID54069243
Molecular FormulaC6H9N3
Molecular Weight123.16 g/mol
Exact Mass123.08
IUPAC Name2-methyl-5-methylidene-4H-pyrimidin-6-amine
SMILESC=C1CN=C(C)N=C1N
InChIInChI=1S/C6H9N3/c1-4-3-8-5(2)9-6(4)7/h1,3H2,2H3,(H2,7,8,9)
InChIKeyFHUXUXBAJYXYRF-UHFFFAOYSA-N
XLogP0.33
TPSA50.74 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500123.16
LogP ≤ 50.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-methylidene-4H-pyrimidin-6-amine?
The IUPAC name of 2-methyl-5-methylidene-4H-pyrimidin-6-amine (CID 54069243) is 2-methyl-5-methylidene-4H-pyrimidin-6-amine.
What is the SMILES notation for 2-methyl-5-methylidene-4H-pyrimidin-6-amine?
The canonical SMILES for 2-methyl-5-methylidene-4H-pyrimidin-6-amine is C=C1CN=C(C)N=C1N.
What is the InChIKey of 2-methyl-5-methylidene-4H-pyrimidin-6-amine?
The InChIKey is FHUXUXBAJYXYRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3/c1-4-3-8-5(2)9-6(4)7/h1,3H2,2H3,(H2,7,8,9).
What are the key properties of 2-methyl-5-methylidene-4H-pyrimidin-6-amine?
2-methyl-5-methylidene-4H-pyrimidin-6-amine has a molecular weight of 123.16 g/mol, XLogP of 0.33, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-methylidene-4H-pyrimidin-6-amine is sourced from PubChem (CID 54069243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).