1,6-dimethyl-4-methylidenepyrimidin-2-amine

C7H11N3 — CID 55291051

IUPAC1,6-dimethyl-4-methylidenepyrimidin-2-amine
SMILESC=C1C=C(C)N(C)C(N)=N1
InChIInChI=1S/C7H11N3/c1-5-4-6(2)10(3)7(8)9-5/h4H,1H2,2-3H3,(H2,8,9)
InChIKeyPWKRBQSIUWMLKF-UHFFFAOYSA-N
MW137.19 g/mol
LogP0.66
Rot. Bonds

About 1,6-dimethyl-4-methylidenepyrimidin-2-amine

1,6-dimethyl-4-methylidenepyrimidin-2-amine (PubChem CID 55291051) has the molecular formula C7H11N3 and a molecular weight of 137.19 g/mol. Its IUPAC name is 1,6-dimethyl-4-methylidenepyrimidin-2-amine.

Molecular Properties

Compound Name1,6-dimethyl-4-methylidenepyrimidin-2-amine
PubChem CID55291051
Molecular FormulaC7H11N3
Molecular Weight137.19 g/mol
Exact Mass137.10
IUPAC Name1,6-dimethyl-4-methylidenepyrimidin-2-amine
SMILESC=C1C=C(C)N(C)C(N)=N1
InChIInChI=1S/C7H11N3/c1-5-4-6(2)10(3)7(8)9-5/h4H,1H2,2-3H3,(H2,8,9)
InChIKeyPWKRBQSIUWMLKF-UHFFFAOYSA-N
XLogP0.66
TPSA41.62 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.19
LogP ≤ 50.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1,6-dimethyl-4-methylidenepyrimidin-2-amine?
The IUPAC name of 1,6-dimethyl-4-methylidenepyrimidin-2-amine (CID 55291051) is 1,6-dimethyl-4-methylidenepyrimidin-2-amine.
What is the SMILES notation for 1,6-dimethyl-4-methylidenepyrimidin-2-amine?
The canonical SMILES for 1,6-dimethyl-4-methylidenepyrimidin-2-amine is C=C1C=C(C)N(C)C(N)=N1.
What is the InChIKey of 1,6-dimethyl-4-methylidenepyrimidin-2-amine?
The InChIKey is PWKRBQSIUWMLKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3/c1-5-4-6(2)10(3)7(8)9-5/h4H,1H2,2-3H3,(H2,8,9).
What are the key properties of 1,6-dimethyl-4-methylidenepyrimidin-2-amine?
1,6-dimethyl-4-methylidenepyrimidin-2-amine has a molecular weight of 137.19 g/mol, XLogP of 0.66, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,6-dimethyl-4-methylidenepyrimidin-2-amine is sourced from PubChem (CID 55291051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).