2-N,2-N,6-N-trimethyl-4-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine

C10H16N8O — CID 106411601

IUPAC2-N,2-N,6-N-trimethyl-4-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine
SMILESCNc1nc(NCc2noc(C)n2)nc(N(C)C)n1
InChIInChI=1S/C10H16N8O/c1-6-13-7(17-19-6)5-12-9-14-8(11-2)15-10(16-9)18(3)4/h5H2,1-4H3,(H2,11,12,14,15,16)
InChIKeyBKKXAWBCAPNDDV-UHFFFAOYSA-N
MW264.29 g/mol
LogP0.28
Rot. Bonds5

About 2-N,2-N,6-N-trimethyl-4-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine

2-N,2-N,6-N-trimethyl-4-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine (PubChem CID 106411601) has the molecular formula C10H16N8O and a molecular weight of 264.29 g/mol. Its IUPAC name is 2-N,2-N,6-N-trimethyl-4-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine.

Molecular Properties

Compound Name2-N,2-N,6-N-trimethyl-4-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine
PubChem CID106411601
Molecular FormulaC10H16N8O
Molecular Weight264.29 g/mol
Exact Mass264.14
IUPAC Name2-N,2-N,6-N-trimethyl-4-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine
SMILESCNc1nc(NCc2noc(C)n2)nc(N(C)C)n1
InChIInChI=1S/C10H16N8O/c1-6-13-7(17-19-6)5-12-9-14-8(11-2)15-10(16-9)18(3)4/h5H2,1-4H3,(H2,11,12,14,15,16)
InChIKeyBKKXAWBCAPNDDV-UHFFFAOYSA-N
XLogP0.28
TPSA104.89 Ų
H-Bond Donors2
H-Bond Acceptors9
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.29
LogP ≤ 50.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 109

Analyze 2-N,2-N,6-N-trimethyl-4-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine with MolForge

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Related Compounds

2-N,2-N,6-N-trimethyl-4-N-[(4-methyl-1,3-thiazol-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine
CID 80807387
4-N-[2-(dimethylamino)ethyl]-2-N,2-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine
CID 80770283
2-N,2-N,6-N-trimethyl-4-N-[(6-methyl-2-pyridinyl)methyl]-1,3,5-triazine-2,4,6-triamine
CID 80821942
4-N-[(5-ethylthiophen-2-yl)methyl]-2-N,2-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine
CID 106015228
2-N,2-N,6-N-trimethyl-4-N-(2-methylsulfanylethyl)-1,3,5-triazine-2,4,6-triamine
CID 80839638
4-N-[2-[[4,6-bis(methylamino)-1,3,5-triazin-2-yl]amino]ethyl]-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine
CID 130243747
2-N,2-N,6-N-trimethyl-4-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]-1,3,5-triazine-2,4,6-triamine
CID 80835200
2-N-methyl-6-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyridine-2,6-diamine
CID 106411587
2-N-methyl-6-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-4-(trifluoromethyl)pyridine-2,6-diamine
CID 106411584
5-methyl-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-4,5-dihydro-1,3-thiazol-2-amine
CID 106406387
6-N-ethyl-2-N,2-N-dimethyl-4-N-(1,2,4-oxadiazol-3-ylmethyl)-1,3,5-triazine-2,4,6-triamine
CID 106411963
4-methyl-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]aniline
CID 103746517

Frequently Asked Questions

What is the IUPAC name of 2-N,2-N,6-N-trimethyl-4-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine?
The IUPAC name of 2-N,2-N,6-N-trimethyl-4-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine (CID 106411601) is 2-N,2-N,6-N-trimethyl-4-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine.
What is the SMILES notation for 2-N,2-N,6-N-trimethyl-4-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine?
The canonical SMILES for 2-N,2-N,6-N-trimethyl-4-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine is CNc1nc(NCc2noc(C)n2)nc(N(C)C)n1.
What is the InChIKey of 2-N,2-N,6-N-trimethyl-4-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine?
The InChIKey is BKKXAWBCAPNDDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N8O/c1-6-13-7(17-19-6)5-12-9-14-8(11-2)15-10(16-9)18(3)4/h5H2,1-4H3,(H2,11,12,14,15,16).
What are the key properties of 2-N,2-N,6-N-trimethyl-4-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine?
2-N,2-N,6-N-trimethyl-4-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine has a molecular weight of 264.29 g/mol, XLogP of 0.28, 5 rotatable bonds, 2 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,2-N,6-N-trimethyl-4-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine is sourced from PubChem (CID 106411601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).