N,N,6,9-tetramethylpurin-2-amine

C9H13N5 — CID 11469568

IUPACN,N,6,9-tetramethylpurin-2-amine
SMILESCc1nc(N(C)C)nc2c1ncn2C
InChIInChI=1S/C9H13N5/c1-6-7-8(14(4)5-10-7)12-9(11-6)13(2)3/h5H,1-4H3
InChIKeyFOEXPGFIIYSJOS-UHFFFAOYSA-N
MW191.24 g/mol
LogP0.74
Rot. Bonds1

About N,N,6,9-tetramethylpurin-2-amine

N,N,6,9-tetramethylpurin-2-amine (PubChem CID 11469568) has the molecular formula C9H13N5 and a molecular weight of 191.24 g/mol. Its IUPAC name is N,N,6,9-tetramethylpurin-2-amine.

Molecular Properties

Compound NameN,N,6,9-tetramethylpurin-2-amine
PubChem CID11469568
Molecular FormulaC9H13N5
Molecular Weight191.24 g/mol
Exact Mass191.12
IUPAC NameN,N,6,9-tetramethylpurin-2-amine
SMILESCc1nc(N(C)C)nc2c1ncn2C
InChIInChI=1S/C9H13N5/c1-6-7-8(14(4)5-10-7)12-9(11-6)13(2)3/h5H,1-4H3
InChIKeyFOEXPGFIIYSJOS-UHFFFAOYSA-N
XLogP0.74
TPSA46.84 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.24
LogP ≤ 50.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,N,6,9-tetramethylpurin-2-amine?
The IUPAC name of N,N,6,9-tetramethylpurin-2-amine (CID 11469568) is N,N,6,9-tetramethylpurin-2-amine.
What is the SMILES notation for N,N,6,9-tetramethylpurin-2-amine?
The canonical SMILES for N,N,6,9-tetramethylpurin-2-amine is Cc1nc(N(C)C)nc2c1ncn2C.
What is the InChIKey of N,N,6,9-tetramethylpurin-2-amine?
The InChIKey is FOEXPGFIIYSJOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N5/c1-6-7-8(14(4)5-10-7)12-9(11-6)13(2)3/h5H,1-4H3.
What are the key properties of N,N,6,9-tetramethylpurin-2-amine?
N,N,6,9-tetramethylpurin-2-amine has a molecular weight of 191.24 g/mol, XLogP of 0.74, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,6,9-tetramethylpurin-2-amine is sourced from PubChem (CID 11469568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).