2-N,6,7-trimethylpteridine-2,4-diamine

C9H12N6 — CID 10750715

IUPAC2-N,6,7-trimethylpteridine-2,4-diamine
SMILESCNc1nc(N)c2nc(C)c(C)nc2n1
InChIInChI=1S/C9H12N6/c1-4-5(2)13-8-6(12-4)7(10)14-9(11-3)15-8/h1-3H3,(H3,10,11,13,14,15)
InChIKeyAMVHGTARHQDXLV-UHFFFAOYSA-N
MW204.24 g/mol
LogP0.66
Rot. Bonds1

About 2-N,6,7-trimethylpteridine-2,4-diamine

2-N,6,7-trimethylpteridine-2,4-diamine (PubChem CID 10750715) has the molecular formula C9H12N6 and a molecular weight of 204.24 g/mol. Its IUPAC name is 2-N,6,7-trimethylpteridine-2,4-diamine.

Molecular Properties

Compound Name2-N,6,7-trimethylpteridine-2,4-diamine
PubChem CID10750715
Molecular FormulaC9H12N6
Molecular Weight204.24 g/mol
Exact Mass204.11
IUPAC Name2-N,6,7-trimethylpteridine-2,4-diamine
SMILESCNc1nc(N)c2nc(C)c(C)nc2n1
InChIInChI=1S/C9H12N6/c1-4-5(2)13-8-6(12-4)7(10)14-9(11-3)15-8/h1-3H3,(H3,10,11,13,14,15)
InChIKeyAMVHGTARHQDXLV-UHFFFAOYSA-N
XLogP0.66
TPSA89.61 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.24
LogP ≤ 50.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-N,6,7-trimethylpteridine-2,4-diamine?
The IUPAC name of 2-N,6,7-trimethylpteridine-2,4-diamine (CID 10750715) is 2-N,6,7-trimethylpteridine-2,4-diamine.
What is the SMILES notation for 2-N,6,7-trimethylpteridine-2,4-diamine?
The canonical SMILES for 2-N,6,7-trimethylpteridine-2,4-diamine is CNc1nc(N)c2nc(C)c(C)nc2n1.
What is the InChIKey of 2-N,6,7-trimethylpteridine-2,4-diamine?
The InChIKey is AMVHGTARHQDXLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N6/c1-4-5(2)13-8-6(12-4)7(10)14-9(11-3)15-8/h1-3H3,(H3,10,11,13,14,15).
What are the key properties of 2-N,6,7-trimethylpteridine-2,4-diamine?
2-N,6,7-trimethylpteridine-2,4-diamine has a molecular weight of 204.24 g/mol, XLogP of 0.66, 1 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,6,7-trimethylpteridine-2,4-diamine is sourced from PubChem (CID 10750715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).