N-(5,6-diethyl-1,2,4-triazin-3-yl)-4-hydroxybenzamide

C14H16N4O2 — CID 114388199

IUPACN-(5,6-diethyl-1,2,4-triazin-3-yl)-4-hydroxybenzamide
SMILESCCc1nnc(NC(=O)c2ccc(O)cc2)nc1CC
InChIInChI=1S/C14H16N4O2/c1-3-11-12(4-2)17-18-14(15-11)16-13(20)9-5-7-10(19)8-6-9/h5-8,19H,3-4H2,1-2H3,(H,15,16,18,20)
InChIKeyBUWOVVZULXFXKH-UHFFFAOYSA-N
MW272.31 g/mol
LogP1.95
Rot. Bonds4

About N-(5,6-diethyl-1,2,4-triazin-3-yl)-4-hydroxybenzamide

N-(5,6-diethyl-1,2,4-triazin-3-yl)-4-hydroxybenzamide (PubChem CID 114388199) has the molecular formula C14H16N4O2 and a molecular weight of 272.31 g/mol. Its IUPAC name is N-(5,6-diethyl-1,2,4-triazin-3-yl)-4-hydroxybenzamide.

Molecular Properties

Compound NameN-(5,6-diethyl-1,2,4-triazin-3-yl)-4-hydroxybenzamide
PubChem CID114388199
Molecular FormulaC14H16N4O2
Molecular Weight272.31 g/mol
Exact Mass272.13
IUPAC NameN-(5,6-diethyl-1,2,4-triazin-3-yl)-4-hydroxybenzamide
SMILESCCc1nnc(NC(=O)c2ccc(O)cc2)nc1CC
InChIInChI=1S/C14H16N4O2/c1-3-11-12(4-2)17-18-14(15-11)16-13(20)9-5-7-10(19)8-6-9/h5-8,19H,3-4H2,1-2H3,(H,15,16,18,20)
InChIKeyBUWOVVZULXFXKH-UHFFFAOYSA-N
XLogP1.95
TPSA88.00 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.31
LogP ≤ 51.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-(5,6-diethyl-1,2,4-triazin-3-yl)-4-hydroxybenzamide 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 N-(5,6-diethyl-1,2,4-triazin-3-yl)-4-hydroxybenzamide?
The IUPAC name of N-(5,6-diethyl-1,2,4-triazin-3-yl)-4-hydroxybenzamide (CID 114388199) is N-(5,6-diethyl-1,2,4-triazin-3-yl)-4-hydroxybenzamide.
What is the SMILES notation for N-(5,6-diethyl-1,2,4-triazin-3-yl)-4-hydroxybenzamide?
The canonical SMILES for N-(5,6-diethyl-1,2,4-triazin-3-yl)-4-hydroxybenzamide is CCc1nnc(NC(=O)c2ccc(O)cc2)nc1CC.
What is the InChIKey of N-(5,6-diethyl-1,2,4-triazin-3-yl)-4-hydroxybenzamide?
The InChIKey is BUWOVVZULXFXKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4O2/c1-3-11-12(4-2)17-18-14(15-11)16-13(20)9-5-7-10(19)8-6-9/h5-8,19H,3-4H2,1-2H3,(H,15,16,18,20).
What are the key properties of N-(5,6-diethyl-1,2,4-triazin-3-yl)-4-hydroxybenzamide?
N-(5,6-diethyl-1,2,4-triazin-3-yl)-4-hydroxybenzamide has a molecular weight of 272.31 g/mol, XLogP of 1.95, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5,6-diethyl-1,2,4-triazin-3-yl)-4-hydroxybenzamide is sourced from PubChem (CID 114388199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).