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

C12H20N4O — CID 104919071

IUPAC[2-[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]cyclohexyl]methanol
SMILESCc1nnc(NC2CCCCC2CO)nc1C
InChIInChI=1S/C12H20N4O/c1-8-9(2)15-16-12(13-8)14-11-6-4-3-5-10(11)7-17/h10-11,17H,3-7H2,1-2H3,(H,13,14,16)
InChIKeyNRFKVWLKEAXALS-UHFFFAOYSA-N
MW236.32 g/mol
LogP1.45
Rot. Bonds3

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

[2-[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]cyclohexyl]methanol (PubChem CID 104919071) has the molecular formula C12H20N4O and a molecular weight of 236.32 g/mol. Its IUPAC name is [2-[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]cyclohexyl]methanol.

Molecular Properties

Compound Name[2-[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]cyclohexyl]methanol
PubChem CID104919071
Molecular FormulaC12H20N4O
Molecular Weight236.32 g/mol
Exact Mass236.16
IUPAC Name[2-[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]cyclohexyl]methanol
SMILESCc1nnc(NC2CCCCC2CO)nc1C
InChIInChI=1S/C12H20N4O/c1-8-9(2)15-16-12(13-8)14-11-6-4-3-5-10(11)7-17/h10-11,17H,3-7H2,1-2H3,(H,13,14,16)
InChIKeyNRFKVWLKEAXALS-UHFFFAOYSA-N
XLogP1.45
TPSA70.93 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 51.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze [2-[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]cyclohexyl]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 [2-[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]cyclohexyl]methanol?
The IUPAC name of [2-[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]cyclohexyl]methanol (CID 104919071) is [2-[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]cyclohexyl]methanol.
What is the SMILES notation for [2-[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]cyclohexyl]methanol?
The canonical SMILES for [2-[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]cyclohexyl]methanol is Cc1nnc(NC2CCCCC2CO)nc1C.
What is the InChIKey of [2-[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]cyclohexyl]methanol?
The InChIKey is NRFKVWLKEAXALS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O/c1-8-9(2)15-16-12(13-8)14-11-6-4-3-5-10(11)7-17/h10-11,17H,3-7H2,1-2H3,(H,13,14,16).
What are the key properties of [2-[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]cyclohexyl]methanol?
[2-[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]cyclohexyl]methanol has a molecular weight of 236.32 g/mol, XLogP of 1.45, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]cyclohexyl]methanol is sourced from PubChem (CID 104919071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).