2-(1,3,5-triazin-2-yl)phenol

C9H7N3O — CID 135828193

IUPAC2-(1,3,5-triazin-2-yl)phenol
SMILESOc1ccccc1-c1ncncn1
InChIInChI=1S/C9H7N3O/c13-8-4-2-1-3-7(8)9-11-5-10-6-12-9/h1-6,13H
InChIKeyHWRLEEPNFJNTOP-UHFFFAOYSA-N
MW173.18 g/mol
LogP1.24
Rot. Bonds1

About 2-(1,3,5-triazin-2-yl)phenol

2-(1,3,5-triazin-2-yl)phenol (PubChem CID 135828193) has the molecular formula C9H7N3O and a molecular weight of 173.18 g/mol. Its IUPAC name is 2-(1,3,5-triazin-2-yl)phenol.

Molecular Properties

Compound Name2-(1,3,5-triazin-2-yl)phenol
PubChem CID135828193
Molecular FormulaC9H7N3O
Molecular Weight173.18 g/mol
Exact Mass173.06
IUPAC Name2-(1,3,5-triazin-2-yl)phenol
SMILESOc1ccccc1-c1ncncn1
InChIInChI=1S/C9H7N3O/c13-8-4-2-1-3-7(8)9-11-5-10-6-12-9/h1-6,13H
InChIKeyHWRLEEPNFJNTOP-UHFFFAOYSA-N
XLogP1.24
TPSA58.90 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.18
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4,6-Diamino-1,3,5-triazin-2-yl)phenol
CID 97600
2-(4-Amino-6-phenyl-1,3,5-triazin-2-yl)phenol
CID 853426
2-(4,6-Diamino-1,3,5-Triazin-2-Yl)benzene-1,4-Diol
CID 135566556
2-(4,6-Diamino-1,3,5-Triazin-2-Yl)-4-Fluorophenol
CID 135566557
2-[4-Methyl-6-(methylamino)-1,3,5-triazin-2-yl]phenol
CID 950458
Phenol, 2,2'-[6-(methylthio)-1,3,5-triazine-2,4-diyl]bis-
CID 3245651
2-(4H-1,2,4-triazol-3-yl)phenol
CID 136008534
2-(4-Amino-6-methyl-1,3,5-triazin-2-yl)phenol
CID 705456
2-(4-Amino-6-propan-2-yl-1,3,5-triazin-2-yl)phenol
CID 136079175
Phenol, 2-(2-pyrimidinyl)-
CID 598941
2-{4-Amino-6-[2-(4-fluorophenyl)vinyl]-1,3,5-triazin-2-yl}phenol
CID 5294237
4-(4,6-Diamino-1,3,5-triazin-2-YL)phenol
CID 4524718

Frequently Asked Questions

What is the IUPAC name of 2-(1,3,5-triazin-2-yl)phenol?
The IUPAC name of 2-(1,3,5-triazin-2-yl)phenol (CID 135828193) is 2-(1,3,5-triazin-2-yl)phenol.
What is the SMILES notation for 2-(1,3,5-triazin-2-yl)phenol?
The canonical SMILES for 2-(1,3,5-triazin-2-yl)phenol is Oc1ccccc1-c1ncncn1.
What is the InChIKey of 2-(1,3,5-triazin-2-yl)phenol?
The InChIKey is HWRLEEPNFJNTOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7N3O/c13-8-4-2-1-3-7(8)9-11-5-10-6-12-9/h1-6,13H.
What are the key properties of 2-(1,3,5-triazin-2-yl)phenol?
2-(1,3,5-triazin-2-yl)phenol has a molecular weight of 173.18 g/mol, XLogP of 1.24, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,3,5-triazin-2-yl)phenol is sourced from PubChem (CID 135828193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).