[1-[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]cyclobutyl]methanol

C10H16N4O — CID 114448760

IUPAC[1-[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]cyclobutyl]methanol
SMILESCc1nnc(NC2(CO)CCC2)nc1C
InChIInChI=1S/C10H16N4O/c1-7-8(2)13-14-9(11-7)12-10(6-15)4-3-5-10/h15H,3-6H2,1-2H3,(H,11,12,14)
InChIKeyLPJXHMZQTHJMRR-UHFFFAOYSA-N
MW208.26 g/mol
LogP0.82
Rot. Bonds3

About [1-[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]cyclobutyl]methanol

[1-[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]cyclobutyl]methanol (PubChem CID 114448760) has the molecular formula C10H16N4O and a molecular weight of 208.26 g/mol. Its IUPAC name is [1-[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]cyclobutyl]methanol.

Molecular Properties

Compound Name[1-[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]cyclobutyl]methanol
PubChem CID114448760
Molecular FormulaC10H16N4O
Molecular Weight208.26 g/mol
Exact Mass208.13
IUPAC Name[1-[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]cyclobutyl]methanol
SMILESCc1nnc(NC2(CO)CCC2)nc1C
InChIInChI=1S/C10H16N4O/c1-7-8(2)13-14-9(11-7)12-10(6-15)4-3-5-10/h15H,3-6H2,1-2H3,(H,11,12,14)
InChIKeyLPJXHMZQTHJMRR-UHFFFAOYSA-N
XLogP0.82
TPSA70.93 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 50.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze [1-[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]cyclobutyl]methanol 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 [1-[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]cyclobutyl]methanol?
The IUPAC name of [1-[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]cyclobutyl]methanol (CID 114448760) is [1-[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]cyclobutyl]methanol.
What is the SMILES notation for [1-[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]cyclobutyl]methanol?
The canonical SMILES for [1-[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]cyclobutyl]methanol is Cc1nnc(NC2(CO)CCC2)nc1C.
What is the InChIKey of [1-[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]cyclobutyl]methanol?
The InChIKey is LPJXHMZQTHJMRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O/c1-7-8(2)13-14-9(11-7)12-10(6-15)4-3-5-10/h15H,3-6H2,1-2H3,(H,11,12,14).
What are the key properties of [1-[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]cyclobutyl]methanol?
[1-[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]cyclobutyl]methanol has a molecular weight of 208.26 g/mol, XLogP of 0.82, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]cyclobutyl]methanol is sourced from PubChem (CID 114448760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).