hydron;1,3,5-triethyl-1,3,5-triazinane

C9H22N3+ — CID 174488604

IUPAChydron;1,3,5-triethyl-1,3,5-triazinane
SMILESCCN1CN(CC)CN(CC)C1.[H+]
InChIInChI=1S/C9H21N3/c1-4-10-7-11(5-2)9-12(6-3)8-10/h4-9H2,1-3H3/p+1
InChIKeyXYRTVIAPRQLSOW-UHFFFAOYSA-O
MW172.30 g/mol
LogP0.95
Rot. Bonds3

About hydron;1,3,5-triethyl-1,3,5-triazinane

hydron;1,3,5-triethyl-1,3,5-triazinane (PubChem CID 174488604) has the molecular formula C9H22N3+ and a molecular weight of 172.30 g/mol. Its IUPAC name is hydron;1,3,5-triethyl-1,3,5-triazinane.

Molecular Properties

Compound Namehydron;1,3,5-triethyl-1,3,5-triazinane
PubChem CID174488604
Molecular FormulaC9H22N3+
Molecular Weight172.30 g/mol
Exact Mass172.18
IUPAC Namehydron;1,3,5-triethyl-1,3,5-triazinane
SMILESCCN1CN(CC)CN(CC)C1.[H+]
InChIInChI=1S/C9H21N3/c1-4-10-7-11(5-2)9-12(6-3)8-10/h4-9H2,1-3H3/p+1
InChIKeyXYRTVIAPRQLSOW-UHFFFAOYSA-O
XLogP0.95
TPSA9.72 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.30
LogP ≤ 50.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of hydron;1,3,5-triethyl-1,3,5-triazinane?
The IUPAC name of hydron;1,3,5-triethyl-1,3,5-triazinane (CID 174488604) is hydron;1,3,5-triethyl-1,3,5-triazinane.
What is the SMILES notation for hydron;1,3,5-triethyl-1,3,5-triazinane?
The canonical SMILES for hydron;1,3,5-triethyl-1,3,5-triazinane is CCN1CN(CC)CN(CC)C1.[H+].
What is the InChIKey of hydron;1,3,5-triethyl-1,3,5-triazinane?
The InChIKey is XYRTVIAPRQLSOW-UHFFFAOYSA-O. The full InChI is InChI=1S/C9H21N3/c1-4-10-7-11(5-2)9-12(6-3)8-10/h4-9H2,1-3H3/p+1.
What are the key properties of hydron;1,3,5-triethyl-1,3,5-triazinane?
hydron;1,3,5-triethyl-1,3,5-triazinane has a molecular weight of 172.30 g/mol, XLogP of 0.95, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for hydron;1,3,5-triethyl-1,3,5-triazinane is sourced from PubChem (CID 174488604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).