4-hydroxy-7,8-dimethyl-10-(2-methylpropyl)-3,4-dihydrobenzo[g]pteridin-2-one

C16H20N4O2 — CID 101229104

IUPAC4-hydroxy-7,8-dimethyl-10-(2-methylpropyl)-3,4-dihydrobenzo[g]pteridin-2-one
SMILESCc1cc2c(cc1C)N(CC(C)C)C1=NC(=O)NC(O)C1=N2
InChIInChI=1S/C16H20N4O2/c1-8(2)7-20-12-6-10(4)9(3)5-11(12)17-13-14(20)18-16(22)19-15(13)21/h5-6,8,15,21H,7H2,1-4H3,(H,19,22)
InChIKeyJZADOHPJUJRPPS-UHFFFAOYSA-N
MW300.36 g/mol
LogP2.29
Rot. Bonds2

About 4-hydroxy-7,8-dimethyl-10-(2-methylpropyl)-3,4-dihydrobenzo[g]pteridin-2-one

4-hydroxy-7,8-dimethyl-10-(2-methylpropyl)-3,4-dihydrobenzo[g]pteridin-2-one (PubChem CID 101229104) has the molecular formula C16H20N4O2 and a molecular weight of 300.36 g/mol. Its IUPAC name is 4-hydroxy-7,8-dimethyl-10-(2-methylpropyl)-3,4-dihydrobenzo[g]pteridin-2-one.

Molecular Properties

Compound Name4-hydroxy-7,8-dimethyl-10-(2-methylpropyl)-3,4-dihydrobenzo[g]pteridin-2-one
PubChem CID101229104
Molecular FormulaC16H20N4O2
Molecular Weight300.36 g/mol
Exact Mass300.16
IUPAC Name4-hydroxy-7,8-dimethyl-10-(2-methylpropyl)-3,4-dihydrobenzo[g]pteridin-2-one
SMILESCc1cc2c(cc1C)N(CC(C)C)C1=NC(=O)NC(O)C1=N2
InChIInChI=1S/C16H20N4O2/c1-8(2)7-20-12-6-10(4)9(3)5-11(12)17-13-14(20)18-16(22)19-15(13)21/h5-6,8,15,21H,7H2,1-4H3,(H,19,22)
InChIKeyJZADOHPJUJRPPS-UHFFFAOYSA-N
XLogP2.29
TPSA77.29 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 52.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4-hydroxy-7,8-dimethyl-10-(2-methylpropyl)-3,4-dihydrobenzo[g]pteridin-2-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-hydroxy-7,8-dimethyl-10-(2-methylpropyl)-3,4-dihydrobenzo[g]pteridin-2-one?
The IUPAC name of 4-hydroxy-7,8-dimethyl-10-(2-methylpropyl)-3,4-dihydrobenzo[g]pteridin-2-one (CID 101229104) is 4-hydroxy-7,8-dimethyl-10-(2-methylpropyl)-3,4-dihydrobenzo[g]pteridin-2-one.
What is the SMILES notation for 4-hydroxy-7,8-dimethyl-10-(2-methylpropyl)-3,4-dihydrobenzo[g]pteridin-2-one?
The canonical SMILES for 4-hydroxy-7,8-dimethyl-10-(2-methylpropyl)-3,4-dihydrobenzo[g]pteridin-2-one is Cc1cc2c(cc1C)N(CC(C)C)C1=NC(=O)NC(O)C1=N2.
What is the InChIKey of 4-hydroxy-7,8-dimethyl-10-(2-methylpropyl)-3,4-dihydrobenzo[g]pteridin-2-one?
The InChIKey is JZADOHPJUJRPPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O2/c1-8(2)7-20-12-6-10(4)9(3)5-11(12)17-13-14(20)18-16(22)19-15(13)21/h5-6,8,15,21H,7H2,1-4H3,(H,19,22).
What are the key properties of 4-hydroxy-7,8-dimethyl-10-(2-methylpropyl)-3,4-dihydrobenzo[g]pteridin-2-one?
4-hydroxy-7,8-dimethyl-10-(2-methylpropyl)-3,4-dihydrobenzo[g]pteridin-2-one has a molecular weight of 300.36 g/mol, XLogP of 2.29, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-7,8-dimethyl-10-(2-methylpropyl)-3,4-dihydrobenzo[g]pteridin-2-one is sourced from PubChem (CID 101229104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).