2-(2-decoxyethyl)-1,3,5-triazine

C15H27N3O — CID 151479987

IUPAC2-(2-decoxyethyl)-1,3,5-triazine
SMILESCCCCCCCCCCOCCc1ncncn1
InChIInChI=1S/C15H27N3O/c1-2-3-4-5-6-7-8-9-11-19-12-10-15-17-13-16-14-18-15/h13-14H,2-12H2,1H3
InChIKeyPMGPOPNKFDTMBB-UHFFFAOYSA-N
MW265.40 g/mol
LogP3.57
Rot. Bonds12

About 2-(2-decoxyethyl)-1,3,5-triazine

2-(2-decoxyethyl)-1,3,5-triazine (PubChem CID 151479987) has the molecular formula C15H27N3O and a molecular weight of 265.40 g/mol. Its IUPAC name is 2-(2-decoxyethyl)-1,3,5-triazine.

Molecular Properties

Compound Name2-(2-decoxyethyl)-1,3,5-triazine
PubChem CID151479987
Molecular FormulaC15H27N3O
Molecular Weight265.40 g/mol
Exact Mass265.22
IUPAC Name2-(2-decoxyethyl)-1,3,5-triazine
SMILESCCCCCCCCCCOCCc1ncncn1
InChIInChI=1S/C15H27N3O/c1-2-3-4-5-6-7-8-9-11-19-12-10-15-17-13-16-14-18-15/h13-14H,2-12H2,1H3
InChIKeyPMGPOPNKFDTMBB-UHFFFAOYSA-N
XLogP3.57
TPSA47.90 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds12
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 53.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

6-(2-Octadecoxyethyl)-1,3,5-triazine-2,4-diamine
CID 56617929
2-(Oxolan-2-ylmethyl)-1,3,5-triazine
CID 140057154
2-(2-Ethoxyethyl)-1,3,5-triazine
CID 154079606
6-(2-Heptyloxyethyl)-1,3,5-triazine-2,4-diamine
CID 4109254

Frequently Asked Questions

What is the IUPAC name of 2-(2-decoxyethyl)-1,3,5-triazine?
The IUPAC name of 2-(2-decoxyethyl)-1,3,5-triazine (CID 151479987) is 2-(2-decoxyethyl)-1,3,5-triazine.
What is the SMILES notation for 2-(2-decoxyethyl)-1,3,5-triazine?
The canonical SMILES for 2-(2-decoxyethyl)-1,3,5-triazine is CCCCCCCCCCOCCc1ncncn1.
What is the InChIKey of 2-(2-decoxyethyl)-1,3,5-triazine?
The InChIKey is PMGPOPNKFDTMBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O/c1-2-3-4-5-6-7-8-9-11-19-12-10-15-17-13-16-14-18-15/h13-14H,2-12H2,1H3.
What are the key properties of 2-(2-decoxyethyl)-1,3,5-triazine?
2-(2-decoxyethyl)-1,3,5-triazine has a molecular weight of 265.40 g/mol, XLogP of 3.57, 12 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-decoxyethyl)-1,3,5-triazine is sourced from PubChem (CID 151479987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).