4-amino-2-(dimethylamino)-5H-pteridin-6-one

C8H10N6O — CID 171384122

IUPAC4-amino-2-(dimethylamino)-5H-pteridin-6-one
SMILESCN(C)c1nc(N)c2[nH]c(=O)cnc2n1
InChIInChI=1S/C8H10N6O/c1-14(2)8-12-6(9)5-7(13-8)10-3-4(15)11-5/h3H,1-2H3,(H,11,15)(H2,9,10,12,13)
InChIKeyIBOVMNRCROFVAN-UHFFFAOYSA-N
MW206.21 g/mol
LogP-0.64
Rot. Bonds1

About 4-amino-2-(dimethylamino)-5H-pteridin-6-one

4-amino-2-(dimethylamino)-5H-pteridin-6-one (PubChem CID 171384122) has the molecular formula C8H10N6O and a molecular weight of 206.21 g/mol. Its IUPAC name is 4-amino-2-(dimethylamino)-5H-pteridin-6-one.

Molecular Properties

Compound Name4-amino-2-(dimethylamino)-5H-pteridin-6-one
PubChem CID171384122
Molecular FormulaC8H10N6O
Molecular Weight206.21 g/mol
Exact Mass206.09
IUPAC Name4-amino-2-(dimethylamino)-5H-pteridin-6-one
SMILESCN(C)c1nc(N)c2[nH]c(=O)cnc2n1
InChIInChI=1S/C8H10N6O/c1-14(2)8-12-6(9)5-7(13-8)10-3-4(15)11-5/h3H,1-2H3,(H,11,15)(H2,9,10,12,13)
InChIKeyIBOVMNRCROFVAN-UHFFFAOYSA-N
XLogP-0.64
TPSA100.79 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.21
LogP ≤ 5-0.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 4-amino-2-(dimethylamino)-5H-pteridin-6-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-amino-2-(dimethylamino)-5H-pteridin-6-one?
The IUPAC name of 4-amino-2-(dimethylamino)-5H-pteridin-6-one (CID 171384122) is 4-amino-2-(dimethylamino)-5H-pteridin-6-one.
What is the SMILES notation for 4-amino-2-(dimethylamino)-5H-pteridin-6-one?
The canonical SMILES for 4-amino-2-(dimethylamino)-5H-pteridin-6-one is CN(C)c1nc(N)c2[nH]c(=O)cnc2n1.
What is the InChIKey of 4-amino-2-(dimethylamino)-5H-pteridin-6-one?
The InChIKey is IBOVMNRCROFVAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N6O/c1-14(2)8-12-6(9)5-7(13-8)10-3-4(15)11-5/h3H,1-2H3,(H,11,15)(H2,9,10,12,13).
What are the key properties of 4-amino-2-(dimethylamino)-5H-pteridin-6-one?
4-amino-2-(dimethylamino)-5H-pteridin-6-one has a molecular weight of 206.21 g/mol, XLogP of -0.64, 1 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-2-(dimethylamino)-5H-pteridin-6-one is sourced from PubChem (CID 171384122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).