1-phenylmethoxy-2H-1,3,5-triazine

C10H11N3O — CID 67687700

IUPAC1-phenylmethoxy-2H-1,3,5-triazine
SMILESC1=NC=NCN1OCc1ccccc1
InChIInChI=1S/C10H11N3O/c1-2-4-10(5-3-1)6-14-13-8-11-7-12-9-13/h1-5,7-8H,6,9H2
InChIKeyOJRVCRQVXJWTPC-UHFFFAOYSA-N
MW189.22 g/mol
LogP1.45
Rot. Bonds3

About 1-phenylmethoxy-2H-1,3,5-triazine

1-phenylmethoxy-2H-1,3,5-triazine (PubChem CID 67687700) has the molecular formula C10H11N3O and a molecular weight of 189.22 g/mol. Its IUPAC name is 1-phenylmethoxy-2H-1,3,5-triazine.

Molecular Properties

Compound Name1-phenylmethoxy-2H-1,3,5-triazine
PubChem CID67687700
Molecular FormulaC10H11N3O
Molecular Weight189.22 g/mol
Exact Mass189.09
IUPAC Name1-phenylmethoxy-2H-1,3,5-triazine
SMILESC1=NC=NCN1OCc1ccccc1
InChIInChI=1S/C10H11N3O/c1-2-4-10(5-3-1)6-14-13-8-11-7-12-9-13/h1-5,7-8H,6,9H2
InChIKeyOJRVCRQVXJWTPC-UHFFFAOYSA-N
XLogP1.45
TPSA37.19 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.22
LogP ≤ 51.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-phenylmethoxy-2H-1,3,5-triazine?
The IUPAC name of 1-phenylmethoxy-2H-1,3,5-triazine (CID 67687700) is 1-phenylmethoxy-2H-1,3,5-triazine.
What is the SMILES notation for 1-phenylmethoxy-2H-1,3,5-triazine?
The canonical SMILES for 1-phenylmethoxy-2H-1,3,5-triazine is C1=NC=NCN1OCc1ccccc1.
What is the InChIKey of 1-phenylmethoxy-2H-1,3,5-triazine?
The InChIKey is OJRVCRQVXJWTPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O/c1-2-4-10(5-3-1)6-14-13-8-11-7-12-9-13/h1-5,7-8H,6,9H2.
What are the key properties of 1-phenylmethoxy-2H-1,3,5-triazine?
1-phenylmethoxy-2H-1,3,5-triazine has a molecular weight of 189.22 g/mol, XLogP of 1.45, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenylmethoxy-2H-1,3,5-triazine is sourced from PubChem (CID 67687700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).