2-[[4,6-bis(methylamino)-1,3,5-triazin-2-yl]amino]ethanol

C7H14N6O — CID 58763740

IUPAC2-[[4,6-bis(methylamino)-1,3,5-triazin-2-yl]amino]ethanol
SMILESCNc1nc(NC)nc(NCCO)n1
InChIInChI=1S/C7H14N6O/c1-8-5-11-6(9-2)13-7(12-5)10-3-4-14/h14H,3-4H2,1-2H3,(H3,8,9,10,11,12,13)
InChIKeyLFYCFONFZQEAEU-UHFFFAOYSA-N
MW198.23 g/mol
LogP-0.64
Rot. Bonds5

About 2-[[4,6-bis(methylamino)-1,3,5-triazin-2-yl]amino]ethanol

2-[[4,6-bis(methylamino)-1,3,5-triazin-2-yl]amino]ethanol (PubChem CID 58763740) has the molecular formula C7H14N6O and a molecular weight of 198.23 g/mol. Its IUPAC name is 2-[[4,6-bis(methylamino)-1,3,5-triazin-2-yl]amino]ethanol.

Molecular Properties

Compound Name2-[[4,6-bis(methylamino)-1,3,5-triazin-2-yl]amino]ethanol
PubChem CID58763740
Molecular FormulaC7H14N6O
Molecular Weight198.23 g/mol
Exact Mass198.12
IUPAC Name2-[[4,6-bis(methylamino)-1,3,5-triazin-2-yl]amino]ethanol
SMILESCNc1nc(NC)nc(NCCO)n1
InChIInChI=1S/C7H14N6O/c1-8-5-11-6(9-2)13-7(12-5)10-3-4-14/h14H,3-4H2,1-2H3,(H3,8,9,10,11,12,13)
InChIKeyLFYCFONFZQEAEU-UHFFFAOYSA-N
XLogP-0.64
TPSA94.99 Ų
H-Bond Donors4
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.23
LogP ≤ 5-0.64
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 107

Analyze 2-[[4,6-bis(methylamino)-1,3,5-triazin-2-yl]amino]ethanol 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-[[4,6-bis(methylamino)-1,3,5-triazin-2-yl]amino]ethanol?
The IUPAC name of 2-[[4,6-bis(methylamino)-1,3,5-triazin-2-yl]amino]ethanol (CID 58763740) is 2-[[4,6-bis(methylamino)-1,3,5-triazin-2-yl]amino]ethanol.
What is the SMILES notation for 2-[[4,6-bis(methylamino)-1,3,5-triazin-2-yl]amino]ethanol?
The canonical SMILES for 2-[[4,6-bis(methylamino)-1,3,5-triazin-2-yl]amino]ethanol is CNc1nc(NC)nc(NCCO)n1.
What is the InChIKey of 2-[[4,6-bis(methylamino)-1,3,5-triazin-2-yl]amino]ethanol?
The InChIKey is LFYCFONFZQEAEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N6O/c1-8-5-11-6(9-2)13-7(12-5)10-3-4-14/h14H,3-4H2,1-2H3,(H3,8,9,10,11,12,13).
What are the key properties of 2-[[4,6-bis(methylamino)-1,3,5-triazin-2-yl]amino]ethanol?
2-[[4,6-bis(methylamino)-1,3,5-triazin-2-yl]amino]ethanol has a molecular weight of 198.23 g/mol, XLogP of -0.64, 5 rotatable bonds, 4 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[4,6-bis(methylamino)-1,3,5-triazin-2-yl]amino]ethanol is sourced from PubChem (CID 58763740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).