N,N,2-trimethyl-6-(methylaminomethyl)pyrimidin-4-amine

C9H16N4 — CID 83864220

IUPACN,N,2-trimethyl-6-(methylaminomethyl)pyrimidin-4-amine
SMILESCNCc1cc(N(C)C)nc(C)n1
InChIInChI=1S/C9H16N4/c1-7-11-8(6-10-2)5-9(12-7)13(3)4/h5,10H,6H2,1-4H3
InChIKeyBJOSNCMMXDNEED-UHFFFAOYSA-N
MW180.25 g/mol
LogP0.57
Rot. Bonds3

About N,N,2-trimethyl-6-(methylaminomethyl)pyrimidin-4-amine

N,N,2-trimethyl-6-(methylaminomethyl)pyrimidin-4-amine (PubChem CID 83864220) has the molecular formula C9H16N4 and a molecular weight of 180.25 g/mol. Its IUPAC name is N,N,2-trimethyl-6-(methylaminomethyl)pyrimidin-4-amine.

Molecular Properties

Compound NameN,N,2-trimethyl-6-(methylaminomethyl)pyrimidin-4-amine
PubChem CID83864220
Molecular FormulaC9H16N4
Molecular Weight180.25 g/mol
Exact Mass180.14
IUPAC NameN,N,2-trimethyl-6-(methylaminomethyl)pyrimidin-4-amine
SMILESCNCc1cc(N(C)C)nc(C)n1
InChIInChI=1S/C9H16N4/c1-7-11-8(6-10-2)5-9(12-7)13(3)4/h5,10H,6H2,1-4H3
InChIKeyBJOSNCMMXDNEED-UHFFFAOYSA-N
XLogP0.57
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 50.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,N,2-trimethyl-6-(methylaminomethyl)pyrimidin-4-amine?
The IUPAC name of N,N,2-trimethyl-6-(methylaminomethyl)pyrimidin-4-amine (CID 83864220) is N,N,2-trimethyl-6-(methylaminomethyl)pyrimidin-4-amine.
What is the SMILES notation for N,N,2-trimethyl-6-(methylaminomethyl)pyrimidin-4-amine?
The canonical SMILES for N,N,2-trimethyl-6-(methylaminomethyl)pyrimidin-4-amine is CNCc1cc(N(C)C)nc(C)n1.
What is the InChIKey of N,N,2-trimethyl-6-(methylaminomethyl)pyrimidin-4-amine?
The InChIKey is BJOSNCMMXDNEED-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N4/c1-7-11-8(6-10-2)5-9(12-7)13(3)4/h5,10H,6H2,1-4H3.
What are the key properties of N,N,2-trimethyl-6-(methylaminomethyl)pyrimidin-4-amine?
N,N,2-trimethyl-6-(methylaminomethyl)pyrimidin-4-amine has a molecular weight of 180.25 g/mol, XLogP of 0.57, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,2-trimethyl-6-(methylaminomethyl)pyrimidin-4-amine is sourced from PubChem (CID 83864220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).