6-(3,3-dimethylmorpholin-4-yl)-4-N,4-N-dimethyl-2-N-propyl-1,3,5-triazine-2,4-diamine

C14H26N6O — CID 80779775

IUPAC6-(3,3-dimethylmorpholin-4-yl)-4-N,4-N-dimethyl-2-N-propyl-1,3,5-triazine-2,4-diamine
SMILESCCCNc1nc(N(C)C)nc(N2CCOCC2(C)C)n1
InChIInChI=1S/C14H26N6O/c1-6-7-15-11-16-12(19(4)5)18-13(17-11)20-8-9-21-10-14(20,2)3/h6-10H2,1-5H3,(H,15,16,17,18)
InChIKeyXEVNNTIRBBZDEX-UHFFFAOYSA-N
MW294.40 g/mol
LogP1.37
Rot. Bonds5

About 6-(3,3-dimethylmorpholin-4-yl)-4-N,4-N-dimethyl-2-N-propyl-1,3,5-triazine-2,4-diamine

6-(3,3-dimethylmorpholin-4-yl)-4-N,4-N-dimethyl-2-N-propyl-1,3,5-triazine-2,4-diamine (PubChem CID 80779775) has the molecular formula C14H26N6O and a molecular weight of 294.40 g/mol. Its IUPAC name is 6-(3,3-dimethylmorpholin-4-yl)-4-N,4-N-dimethyl-2-N-propyl-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name6-(3,3-dimethylmorpholin-4-yl)-4-N,4-N-dimethyl-2-N-propyl-1,3,5-triazine-2,4-diamine
PubChem CID80779775
Molecular FormulaC14H26N6O
Molecular Weight294.40 g/mol
Exact Mass294.22
IUPAC Name6-(3,3-dimethylmorpholin-4-yl)-4-N,4-N-dimethyl-2-N-propyl-1,3,5-triazine-2,4-diamine
SMILESCCCNc1nc(N(C)C)nc(N2CCOCC2(C)C)n1
InChIInChI=1S/C14H26N6O/c1-6-7-15-11-16-12(19(4)5)18-13(17-11)20-8-9-21-10-14(20,2)3/h6-10H2,1-5H3,(H,15,16,17,18)
InChIKeyXEVNNTIRBBZDEX-UHFFFAOYSA-N
XLogP1.37
TPSA66.41 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.40
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 6-(3,3-dimethylmorpholin-4-yl)-4-N,4-N-dimethyl-2-N-propyl-1,3,5-triazine-2,4-diamine?
The IUPAC name of 6-(3,3-dimethylmorpholin-4-yl)-4-N,4-N-dimethyl-2-N-propyl-1,3,5-triazine-2,4-diamine (CID 80779775) is 6-(3,3-dimethylmorpholin-4-yl)-4-N,4-N-dimethyl-2-N-propyl-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 6-(3,3-dimethylmorpholin-4-yl)-4-N,4-N-dimethyl-2-N-propyl-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 6-(3,3-dimethylmorpholin-4-yl)-4-N,4-N-dimethyl-2-N-propyl-1,3,5-triazine-2,4-diamine is CCCNc1nc(N(C)C)nc(N2CCOCC2(C)C)n1.
What is the InChIKey of 6-(3,3-dimethylmorpholin-4-yl)-4-N,4-N-dimethyl-2-N-propyl-1,3,5-triazine-2,4-diamine?
The InChIKey is XEVNNTIRBBZDEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N6O/c1-6-7-15-11-16-12(19(4)5)18-13(17-11)20-8-9-21-10-14(20,2)3/h6-10H2,1-5H3,(H,15,16,17,18).
What are the key properties of 6-(3,3-dimethylmorpholin-4-yl)-4-N,4-N-dimethyl-2-N-propyl-1,3,5-triazine-2,4-diamine?
6-(3,3-dimethylmorpholin-4-yl)-4-N,4-N-dimethyl-2-N-propyl-1,3,5-triazine-2,4-diamine has a molecular weight of 294.40 g/mol, XLogP of 1.37, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3,3-dimethylmorpholin-4-yl)-4-N,4-N-dimethyl-2-N-propyl-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 80779775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).