1,3-dimethoxy-5-methyl-1,3,5-triazinane

C6H15N3O2 — CID 143758568

IUPAC1,3-dimethoxy-5-methyl-1,3,5-triazinane
SMILESCON1CN(C)CN(OC)C1
InChIInChI=1S/C6H15N3O2/c1-7-4-8(10-2)6-9(5-7)11-3/h4-6H2,1-3H3
InChIKeyCDUKPWOIKIPHNY-UHFFFAOYSA-N
MW161.21 g/mol
LogP-0.47
Rot. Bonds2

About 1,3-dimethoxy-5-methyl-1,3,5-triazinane

1,3-dimethoxy-5-methyl-1,3,5-triazinane (PubChem CID 143758568) has the molecular formula C6H15N3O2 and a molecular weight of 161.21 g/mol. Its IUPAC name is 1,3-dimethoxy-5-methyl-1,3,5-triazinane.

Molecular Properties

Compound Name1,3-dimethoxy-5-methyl-1,3,5-triazinane
PubChem CID143758568
Molecular FormulaC6H15N3O2
Molecular Weight161.21 g/mol
Exact Mass161.12
IUPAC Name1,3-dimethoxy-5-methyl-1,3,5-triazinane
SMILESCON1CN(C)CN(OC)C1
InChIInChI=1S/C6H15N3O2/c1-7-4-8(10-2)6-9(5-7)11-3/h4-6H2,1-3H3
InChIKeyCDUKPWOIKIPHNY-UHFFFAOYSA-N
XLogP-0.47
TPSA28.18 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.21
LogP ≤ 5-0.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 1,3-dimethoxy-5-methyl-1,3,5-triazinane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1,3-dimethoxy-5-methyl-1,3,5-triazinane?
The IUPAC name of 1,3-dimethoxy-5-methyl-1,3,5-triazinane (CID 143758568) is 1,3-dimethoxy-5-methyl-1,3,5-triazinane.
What is the SMILES notation for 1,3-dimethoxy-5-methyl-1,3,5-triazinane?
The canonical SMILES for 1,3-dimethoxy-5-methyl-1,3,5-triazinane is CON1CN(C)CN(OC)C1.
What is the InChIKey of 1,3-dimethoxy-5-methyl-1,3,5-triazinane?
The InChIKey is CDUKPWOIKIPHNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15N3O2/c1-7-4-8(10-2)6-9(5-7)11-3/h4-6H2,1-3H3.
What are the key properties of 1,3-dimethoxy-5-methyl-1,3,5-triazinane?
1,3-dimethoxy-5-methyl-1,3,5-triazinane has a molecular weight of 161.21 g/mol, XLogP of -0.47, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dimethoxy-5-methyl-1,3,5-triazinane is sourced from PubChem (CID 143758568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).