2,2,4,4,6-pentamethyl-1,3-diazinane

C9H20N2 — CID 14549898

IUPAC2,2,4,4,6-pentamethyl-1,3-diazinane
SMILESCC1CC(C)(C)NC(C)(C)N1
InChIInChI=1S/C9H20N2/c1-7-6-8(2,3)11-9(4,5)10-7/h7,10-11H,6H2,1-5H3
InChIKeyQSSWKPVVDJURMQ-UHFFFAOYSA-N
MW156.27 g/mol
LogP1.47
Rot. Bonds

About 2,2,4,4,6-pentamethyl-1,3-diazinane

2,2,4,4,6-pentamethyl-1,3-diazinane (PubChem CID 14549898) has the molecular formula C9H20N2 and a molecular weight of 156.27 g/mol. Its IUPAC name is 2,2,4,4,6-pentamethyl-1,3-diazinane.

Molecular Properties

Compound Name2,2,4,4,6-pentamethyl-1,3-diazinane
PubChem CID14549898
Molecular FormulaC9H20N2
Molecular Weight156.27 g/mol
Exact Mass156.16
IUPAC Name2,2,4,4,6-pentamethyl-1,3-diazinane
SMILESCC1CC(C)(C)NC(C)(C)N1
InChIInChI=1S/C9H20N2/c1-7-6-8(2,3)11-9(4,5)10-7/h7,10-11H,6H2,1-5H3
InChIKeyQSSWKPVVDJURMQ-UHFFFAOYSA-N
XLogP1.47
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.27
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,2,4,4,6-pentamethyl-1,3-diazinane?
The IUPAC name of 2,2,4,4,6-pentamethyl-1,3-diazinane (CID 14549898) is 2,2,4,4,6-pentamethyl-1,3-diazinane.
What is the SMILES notation for 2,2,4,4,6-pentamethyl-1,3-diazinane?
The canonical SMILES for 2,2,4,4,6-pentamethyl-1,3-diazinane is CC1CC(C)(C)NC(C)(C)N1.
What is the InChIKey of 2,2,4,4,6-pentamethyl-1,3-diazinane?
The InChIKey is QSSWKPVVDJURMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2/c1-7-6-8(2,3)11-9(4,5)10-7/h7,10-11H,6H2,1-5H3.
What are the key properties of 2,2,4,4,6-pentamethyl-1,3-diazinane?
2,2,4,4,6-pentamethyl-1,3-diazinane has a molecular weight of 156.27 g/mol, XLogP of 1.47, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,4,4,6-pentamethyl-1,3-diazinane is sourced from PubChem (CID 14549898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).