2-N,6,7-trimethyl-5,6,7,8-tetrahydropteridine-2,4-diamine

C9H16N6 — CID 10703582

IUPAC2-N,6,7-trimethyl-5,6,7,8-tetrahydropteridine-2,4-diamine
SMILESCNc1nc(N)c2c(n1)NC(C)C(C)N2
InChIInChI=1S/C9H16N6/c1-4-5(2)13-8-6(12-4)7(10)14-9(11-3)15-8/h4-5,12H,1-3H3,(H4,10,11,13,14,15)
InChIKeyUEMGELRGDQYAPX-UHFFFAOYSA-N
MW208.27 g/mol
LogP0.71
Rot. Bonds1

About 2-N,6,7-trimethyl-5,6,7,8-tetrahydropteridine-2,4-diamine

2-N,6,7-trimethyl-5,6,7,8-tetrahydropteridine-2,4-diamine (PubChem CID 10703582) has the molecular formula C9H16N6 and a molecular weight of 208.27 g/mol. Its IUPAC name is 2-N,6,7-trimethyl-5,6,7,8-tetrahydropteridine-2,4-diamine.

Molecular Properties

Compound Name2-N,6,7-trimethyl-5,6,7,8-tetrahydropteridine-2,4-diamine
PubChem CID10703582
Molecular FormulaC9H16N6
Molecular Weight208.27 g/mol
Exact Mass208.14
IUPAC Name2-N,6,7-trimethyl-5,6,7,8-tetrahydropteridine-2,4-diamine
SMILESCNc1nc(N)c2c(n1)NC(C)C(C)N2
InChIInChI=1S/C9H16N6/c1-4-5(2)13-8-6(12-4)7(10)14-9(11-3)15-8/h4-5,12H,1-3H3,(H4,10,11,13,14,15)
InChIKeyUEMGELRGDQYAPX-UHFFFAOYSA-N
XLogP0.71
TPSA87.89 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.27
LogP ≤ 50.71
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-N,6,7-trimethyl-5,6,7,8-tetrahydropteridine-2,4-diamine?
The IUPAC name of 2-N,6,7-trimethyl-5,6,7,8-tetrahydropteridine-2,4-diamine (CID 10703582) is 2-N,6,7-trimethyl-5,6,7,8-tetrahydropteridine-2,4-diamine.
What is the SMILES notation for 2-N,6,7-trimethyl-5,6,7,8-tetrahydropteridine-2,4-diamine?
The canonical SMILES for 2-N,6,7-trimethyl-5,6,7,8-tetrahydropteridine-2,4-diamine is CNc1nc(N)c2c(n1)NC(C)C(C)N2.
What is the InChIKey of 2-N,6,7-trimethyl-5,6,7,8-tetrahydropteridine-2,4-diamine?
The InChIKey is UEMGELRGDQYAPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N6/c1-4-5(2)13-8-6(12-4)7(10)14-9(11-3)15-8/h4-5,12H,1-3H3,(H4,10,11,13,14,15).
What are the key properties of 2-N,6,7-trimethyl-5,6,7,8-tetrahydropteridine-2,4-diamine?
2-N,6,7-trimethyl-5,6,7,8-tetrahydropteridine-2,4-diamine has a molecular weight of 208.27 g/mol, XLogP of 0.71, 1 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,6,7-trimethyl-5,6,7,8-tetrahydropteridine-2,4-diamine is sourced from PubChem (CID 10703582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).